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When developing chemical systems it’s of course important to gain a deep understanding of the chemical reaction process. In an article, author is Bahia, Malkeet Singh, once mentioned the application of 94569-84-3, Name is 2-Bromo-5-fluorobenzaldehyde, molecular formula is C7H4BrFO, molecular weight is 203.01, MDL number is MFCD00142872, category is thiomorpholine. Now introduce a scientific discovery about this category, Electric Literature of 94569-84-3.

Thiomorpholine analogs (TML) have been identified as novel class of potent tumor necrosis factor-alpha converting enzyme (TACE) inhibitors. A computational strategy based on molecular docking studies, followed by MFA analysis has been performed to elucidate the atomic details of the TACE/TML interactions and to identify the most important features impacting TACE inhibitory activity of TMLs. The generated MFA model resulted to be well predictive, and gave r(test)(2) 0.723, conventional r(2) 0.982 and r(cv)(2) 0.811. The 3D-QSAR field contributions and the structural features of the TACE binding site showed a good correlation. These studies will be useful to design new TACE inhibitors with improved potency.

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Thiomorpholine – Wikipedia,
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This paper describes the synthesis and anti-inflammatory activity of new N-phenyl-phthalimide sulfonamides (3a-e) and the isosters N-phenyl-phthalimide amides (4a-e), designed as hybrids of thalidomide (1) and aryl sulfonamide phosphodiesterase inhibitor (2), In these series, compound 3e (LASSBio 468). having a sulfonyl-thiomorpholine moiety, showed potent inhibitory activity on LPS-induced neutrophil recruitment with ED50 = 2.5 mg kg(-1), which was correlated with its inhibitory effect on TNF-alpha level. (C) 2002 Elsevier Science Ltd. All rights reserved.

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Thiomorpholine – Wikipedia,
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Herein, we describe the synthesis and characterizations of 2,4,6-tris(thiomorpholine)-1,3,5-triazine, 2,4,6-tris(piperazine)-1,3,5-triazine and their new Sb(III) and Bi(III) complexes. Characterizations of the ligands and complexes were carried out by elemental analysis, thermogravimetric analysis (TGA), and spectroscopic methods such as infrared (IR), H-1 and C-13 nuclear magnetic resonance (NMR), and single crystal X-ray. Theoretical vibrational frequencies and H-1 and C-13 NMR chemical shifts of free ligands as well as their Sb(III) and Bi(III) complexes have been calculated using density functional theory (DFT/B3LYP and M06-2X) methods. Our theoretical results matched the corresponding experimental data and helped with the interpretation of the IR and H-1 and C-13 NMR spectra. The antimicrobial in vitro studies were carried out against bacterial species Staphylococcus aureus and fungal species Candida albicans, Candida tropicalis, and Candida krusei by the microdilution method. The preliminary antimicrobial evaluations indicated that Sb(III) complexes showed moderate activities against all tested strains of bacterial and fungal with minimum inhibitory concentration (MIC) in range of 512-1024 mu g mL(-1). (C) 2019 Elsevier B.V. All rights reserved.

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Thiomorpholine – Wikipedia,
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In order to see if the biodegradative pathways for morpholine and thiomorpholine during degradation by Mycobacterium aurum MO1 could be generalized to other heterocyclic compounds, the degradation of piperidine by this strain was investigated by performing H-1-nuclear magnetic rc:resonance directly with the incubation medium. Ionspray mass spectrometry, performed without purification of the samples, was also used to confirm the structure of some metabolites during morpholine and thiomorpholine degradation. The results obtained with these tyro techniques suggested a general pathway for degradation of nitrogen heterocyclic compounds by M. aurum MO1. The first step of the degradative pathway is cleavage of the C-N bond; this leads formation of an intermediary amino acid, which is followed by deamination and oxidation of this amino acid into a diacid. Except in the case of thiodiglycolate obtained from thiomorpholine degradation, the dicarboxylates are completely mineralized by the bacterial cells. A comparison with previously published data showed that this pathway could be a general pathway for degradation by other strains of members of the genus Mycobacterium.

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Thiomorpholine – Wikipedia,
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As a society publisher, everything we do is to support the scientific community – so you can trust us to always act in your best interests, and get your work the international recognition that it deserves., Application of 94569-84-3, 94569-84-3, Name is 2-Bromo-5-fluorobenzaldehyde, molecular formula is C7H4BrFO, belongs to thiomorpholine compound. In a document, author is Ibis, Cemil, introduce the new discover.

In the title compound, C11H15Cl3N2O2S2, the thiomorpholine ring adopts a chair conformation and the butadiene has a conformation closer to cisoid than to transoid.

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Thiomorpholine – Wikipedia,
,Thiomorpholine | C4H9NS – PubChem

 

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This paper describes the synthesis and anti-inflammatory activity of new N-phenyl-phthalimide sulfonamides (3a-e) and the isosters N-phenyl-phthalimide amides (4a-e), designed as hybrids of thalidomide (1) and aryl sulfonamide phosphodiesterase inhibitor (2), In these series, compound 3e (LASSBio 468). having a sulfonyl-thiomorpholine moiety, showed potent inhibitory activity on LPS-induced neutrophil recruitment with ED50 = 2.5 mg kg(-1), which was correlated with its inhibitory effect on TNF-alpha level. (C) 2002 Elsevier Science Ltd. All rights reserved.

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Thiomorpholine – Wikipedia,
,Thiomorpholine | C4H9NS – PubChem

 

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Herein, we describe the synthesis and characterizations of 2,4,6-tris(thiomorpholine)-1,3,5-triazine, 2,4,6-tris(piperazine)-1,3,5-triazine and their new Sb(III) and Bi(III) complexes. Characterizations of the ligands and complexes were carried out by elemental analysis, thermogravimetric analysis (TGA), and spectroscopic methods such as infrared (IR), H-1 and C-13 nuclear magnetic resonance (NMR), and single crystal X-ray. Theoretical vibrational frequencies and H-1 and C-13 NMR chemical shifts of free ligands as well as their Sb(III) and Bi(III) complexes have been calculated using density functional theory (DFT/B3LYP and M06-2X) methods. Our theoretical results matched the corresponding experimental data and helped with the interpretation of the IR and H-1 and C-13 NMR spectra. The antimicrobial in vitro studies were carried out against bacterial species Staphylococcus aureus and fungal species Candida albicans, Candida tropicalis, and Candida krusei by the microdilution method. The preliminary antimicrobial evaluations indicated that Sb(III) complexes showed moderate activities against all tested strains of bacterial and fungal with minimum inhibitory concentration (MIC) in range of 512-1024 mu g mL(-1). (C) 2019 Elsevier B.V. All rights reserved.

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In order to see if the biodegradative pathways for morpholine and thiomorpholine during degradation by Mycobacterium aurum MO1 could be generalized to other heterocyclic compounds, the degradation of piperidine by this strain was investigated by performing H-1-nuclear magnetic rc:resonance directly with the incubation medium. Ionspray mass spectrometry, performed without purification of the samples, was also used to confirm the structure of some metabolites during morpholine and thiomorpholine degradation. The results obtained with these tyro techniques suggested a general pathway for degradation of nitrogen heterocyclic compounds by M. aurum MO1. The first step of the degradative pathway is cleavage of the C-N bond; this leads formation of an intermediary amino acid, which is followed by deamination and oxidation of this amino acid into a diacid. Except in the case of thiodiglycolate obtained from thiomorpholine degradation, the dicarboxylates are completely mineralized by the bacterial cells. A comparison with previously published data showed that this pathway could be a general pathway for degradation by other strains of members of the genus Mycobacterium.

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Thiomorpholine – Wikipedia,
,Thiomorpholine | C4H9NS – PubChem

 

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In the title compound, C11H15Cl3N2O2S2, the thiomorpholine ring adopts a chair conformation and the butadiene has a conformation closer to cisoid than to transoid.

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Thiomorpholine analogs (TML) have been identified as novel class of potent tumor necrosis factor-alpha converting enzyme (TACE) inhibitors. A computational strategy based on molecular docking studies, followed by MFA analysis has been performed to elucidate the atomic details of the TACE/TML interactions and to identify the most important features impacting TACE inhibitory activity of TMLs. The generated MFA model resulted to be well predictive, and gave r(test)(2) 0.723, conventional r(2) 0.982 and r(cv)(2) 0.811. The 3D-QSAR field contributions and the structural features of the TACE binding site showed a good correlation. These studies will be useful to design new TACE inhibitors with improved potency.

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Reference:
Thiomorpholine – Wikipedia,
,Thiomorpholine | C4H9NS – PubChem