2,4-Dibromo-5-methylthiazole - CAS 1206708-88-4

Catalog:	BB004924
Product Name:	2,4-Dibromo-5-methylthiazole
CAS:	1206708-88-4
Synonyms:	2,4-dibromo-5-methylthiazole; 2,4-dibromo-5-methyl-1,3-thiazole

Technical Data

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Computed Properties

IUPAC Name:	2,4-dibromo-5-methyl-1,3-thiazole
Description:	2,4-Dibromo-5-methylthiazole (CAS# 1206708-88-4) is a useful research chemical.
Molecular Weight:	256.95
Molecular Formula:	C4H3Br2NS
Canonical SMILES:	CC1=C(N=C(S1)Br)Br
InChI:	InChI=1S/C4H3Br2NS/c1-2-3(5)7-4(6)8-2/h1H3
InChI Key:	HJUNCDFVUMUFOW-UHFFFAOYSA-N
LogP:	2.97650

Publication Number	Title	Priority Date
CN-112341404-A	Novel thiazole derivative or salt, isomer, preparation method and application thereof	20190809
EP-3342765-A1	Cathepsin k inhibitor and application thereof	20150829
US-10494364-B2	Cathepsin K inhibitors and application thereof	20150829
US-2018230138-A1	Cathepsin k inhibitors and application thereof	20150829
WO-2017036357-A1	Cathepsin k inhibitor and application thereof	20150829

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Related Functional Groups

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

Complexity:	90.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	256.83325
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	254.83530
Rotatable Bond Count:	0
Topological Polar Surface Area:	41.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.4