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2281-74-5

2281-74-5 | 1,3-thiazolidin-4-one

CAS No: 2281-74-5 Catalog No: AG01DZ9G MDL No:MFCD17015366

Product Description

Catalog Number:
AG01DZ9G
Chemical Name:
1,3-thiazolidin-4-one
CAS Number:
2281-74-5
Molecular Formula:
C3H5NOS
Molecular Weight:
103.1429
MDL Number:
MFCD17015366
IUPAC Name:
1,3-thiazolidin-4-one
InChI:
InChI=1S/C3H5NOS/c5-3-1-6-2-4-3/h1-2H2,(H,4,5)
InChI Key:
NOLHRFLIXVQPSZ-UHFFFAOYSA-N
SMILES:
C1SCNC1=O

Properties

Complexity:
73.2  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
103.009g/mol
Formal Charge:
0
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
103.139g/mol
Monoisotopic Mass:
103.009g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  

Literature

Title Journal
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Evaluation of 3-(4'-(4″-fluorophenyl)-6'-phenylpyrimidin-2'-yl)-2-phenylthiazolidin-4-one for in vivo modulation of biomarkers of chemoprevention in the 7,12-dimethylbenz[a]anthracene-induced hamster buccal pouch carcinogenesis. Journal of enzyme inhibition and medicinal chemistry 20110601
Synthesis of some novel 2,5-disubstituted thiazolidinones from a long chain fatty acid as possible anti-inflammatory, analgesic and hydrogen peroxide scavenging agents. Journal of enzyme inhibition and medicinal chemistry 20110401
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N-[2-(4-Bromo-phen-yl)-5-methyl-4-oxo-1,3-thia-zolidin-3-yl]pyridine-3-carboxamide. Acta crystallographica. Section E, Structure reports online 20110401
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N-[5-Methyl-2-(2-nitro-phen-yl)-4-oxo-1,3-thia-zolidin-3-yl]pyridine-3-carboxamide monohydrate. Acta crystallographica. Section E, Structure reports online 20110201
3D-QSAR studies on thiazolidin-4-one S1P₁receptor agonists by CoMFA and CoMSIA. International journal of molecular sciences 20110101
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Quantitative structure activity relationship (QSAR) analysis of substituted 4-oxothiazolidines and 5-arylidines as lipoxygenase inhibitors. Mini reviews in medicinal chemistry 20100701
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