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Methyl 2-(2-Bromo-5-methyl-4-thiazolyl)acetate

Methyl 2-(2-Bromo-5-methyl-4-thiazolyl)acetate - CAS 496062-15-8

Catalog:	BB026744
Product Name:	Methyl 2-(2-Bromo-5-methyl-4-thiazolyl)acetate
CAS:	496062-15-8
Synonyms:	2-(2-bromo-5-methyl-4-thiazolyl)acetic acid methyl ester; methyl 2-(2-bromo-5-methyl-1,3-thiazol-4-yl)acetate

Technical Data

Patents

Computed Properties

IUPAC Name:	methyl 2-(2-bromo-5-methyl-1,3-thiazol-4-yl)acetate
Description:	Methyl 2-(2-Bromo-5-methyl-4-thiazolyl)acetate (CAS# 496062-15-8 ) is a useful research chemical.
Molecular Weight:	250.11
Molecular Formula:	C7H8BrNO2S
Canonical SMILES:	CC1=C(N=C(S1)Br)CC(=O)OC
InChI:	InChI=1S/C7H8BrNO2S/c1-4-5(3-6(10)11-2)9-7(8)12-4/h3H2,1-2H3
InChI Key:	YJOOXFDCFOZALL-UHFFFAOYSA-N
LogP:	1.92950

Publication Number	Title	Priority Date
WO-2019218957-A1	Compound as protease activated receptor 4 (par4) inhibitor for treating platelet aggregation	20180516
EP-3548023-A1	Methods of dose administration for treating or preventing cognitive impairment using indane acetic acid derivatives	20161202
US-2018153859-A1	Methods of treating or preventing cognitive impairment using indane acetic acid derivatives based on apoe4 genotype	20161202
US-2018153860-A1	Methods of dose administration for treating or preventing cognitive impairment using indane acetic acid derivatives	20161202
WO-2018102358-A1	Methods of treating or preventing cognitive impairment using indane acetic acid derivatives based on apoe4 genotype	20161202

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Complexity:	179
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	248.94591
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	248.94591
Rotatable Bond Count:	3
Topological Polar Surface Area:	67.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.2