4-(Boc-amino)-2-methylthiazole - CAS 848472-61-7

Catalog:	BB037335
Product Name:	4-(Boc-amino)-2-methylthiazole
CAS:	848472-61-7
Synonyms:	N-(2-methyl-4-thiazolyl)carbamic acid tert-butyl ester; tert-butyl N-(2-methyl-1,3-thiazol-4-yl)carbamate

Technical Data

Patents

Computed Properties

IUPAC Name:	tert-butyl N-(2-methyl-1,3-thiazol-4-yl)carbamate
Description:	4-(Boc-amino)-2-methylthiazole (CAS# 848472-61-7 ) is a useful research chemical.
Molecular Weight:	214.28
Molecular Formula:	C9H14N2O2S
Canonical SMILES:	CC1=NC(=CS1)NC(=O)OC(C)(C)C
InChI:	InChI=1S/C9H14N2O2S/c1-6-10-7(5-14-6)11-8(12)13-9(2,3)4/h5H,1-4H3,(H,11,12)
InChI Key:	NNWHAYYMOHDJME-UHFFFAOYSA-N
LogP:	2.81210

Publication Number	Title	Priority Date
WO-2017051303-A1	Tetrahydropyrano[3,4-d][1,3]oxazin derivatives and their use as bace inhibitors	20150924
WO-2008042353-A1	Potent and highly selective heteroaromatic inhibitors of neuronal nitric oxide synthase	20060929
EP-2287161-A1	Derivatives of 4-piperazin-1-yl-4-benzo[b]thiophene suitable for the treatment of cns disorders	20050831
EP-2287162-A1	Derivatives of 4-piperazin-1-yl-4-benzo[b]thiophene suitable for the treatment of cns disorders	20050831
US-2012028920-A1	Derivatives of 4-piperazin-1-yl-4-benzo[b]thiophene suitable for the treatment of cns disorders	20050831

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Complexity:	215
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	214.07759887
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	214.07759887
Rotatable Bond Count:	3
Topological Polar Surface Area:	79.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.3