(2,4-Dioxo-1,3-thiazolidin-5-yl)acetic acid - CAS 875-97-8

Catalog:	BB038538
Product Name:	(2,4-Dioxo-1,3-thiazolidin-5-yl)acetic acid
CAS:	875-97-8
Synonyms:	2-(2,4-dioxo-1,3-thiazolidin-5-yl)acetic acid

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Computed Properties

IUPAC Name:	2-(2,4-dioxo-1,3-thiazolidin-5-yl)acetic acid
Description:	(2,4-Dioxo-1,3-thiazolidin-5-yl)acetic acid (CAS# 875-97-8) is a useful research chemical.
Molecular Weight:	175.16
Molecular Formula:	C5H5NO4S
Canonical SMILES:	C(C1C(=O)NC(=O)S1)C(=O)O
InChI:	InChI=1S/C5H5NO4S/c7-3(8)1-2-4(9)6-5(10)11-2/h2H,1H2,(H,7,8)(H,6,9,10)
InChI Key:	NYOCHSASHNVXRM-UHFFFAOYSA-N
Boiling Point:	489.3 °C at 760 mmHg
Density:	1.6 g/cm³
LogP:	0.14150

Publication Number	Title	Priority Date
WO-2018145217-A1	Human ets-related gene (erg) compounds as therapeutics and methods for their use	20170213
EP-3018126-A1	Heterocyclic compound	20130703
US-10053468-B2	Heterocyclic compound	20130703
US-2017050974-A1	Heterocyclic compound	20130703
US-2018319812-A1	Heterocyclic compound	20130703

PMID	Publication Date	Title	Journal
22123321	20120101	Synthesis and antihyperglycemic evaluation of new 2,4-thiazolidinediones having biodynamic aryl sulfonylurea moieties	Bioorganic & medicinal chemistry letters
18666428	20080301	Synthesis of amides of 2,4-dioxothiazolidin-5-yl acetic acid with 1,2,4-triazole substituents	Acta poloniae pharmaceutica

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Related Functional Groups

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2-[(2-Nitrophenyl)amino]-1,3-thiazol-4(5H)-one
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Thiazolidine
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2-Isopropylthiazole

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Complexity:	227
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	174.99392881
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	174.99392881
Rotatable Bond Count:	2
Topological Polar Surface Area:	109
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.4