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5-Oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic Acid

5-Oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic Acid - CAS 51991-94-7

Catalog:	BB027676
Product Name:	5-Oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic Acid
CAS:	51991-94-7
Synonyms:	5-oxo-6-thiazolo[3,2-a]pyrimidinecarboxylic acid; 5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylic acid
Description:	5-Oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic Acid (CAS# 51991-94-7) is a useful research chemical.
Molecular Weight:	196.18
Molecular Formula:	C7H4N2O3S
Canonical SMILES:	C1=CSC2=NC=C(C(=O)N21)C(=O)O
InChI:	InChI=1S/C7H4N2O3S/c10-5-4(6(11)12)3-8-7-9(5)1-2-13-7/h1-3H,(H,11,12)
InChI Key:	FDGPDTWORUVKQX-UHFFFAOYSA-N
Boiling Point:	390.9 °C at 760 mmHg
Density:	1.78 g/cm³
LogP:	0.45420

Publication Number	Title	Priority Date
US-2019112316-A1	Thiazolo[3,2-a] pyrimidinone and other heterobicyclic pyrimidinone compounds for use in medical therapy	20150904
WO-2017040879-A1	Thiazolo(3,2-a) pyrimidinone and other heterobicyclic pyrimidinone compounds for use in medical therapy	20150904
AU-2010237750-A1	Derivatives of N-acyl-N'-phenylpiperazine useful (inter alia) for the prophylaxis or treatment of diabetes	20090416
AU-2010237750-A2	Derivatives of N-acyl-N'-phenylpiperazine useful (inter alia) for the prophylaxis or treatment of diabetes	20090416
AU-2010237750-A9	Derivatives of N-acyl-N'-phenylpiperazine useful (inter alia) for the prophylaxis or treatment of diabetes	20090416

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[1427004-19-0]
DBCO-PEG4-NHS ester
[17746-05-3]
Undecanoyl chloride
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	383
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	195.99426317
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	195.99426317
Rotatable Bond Count:	1
Topological Polar Surface Area:	95.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.5