7-methoxybenzo[d]thiazol-2-amine - CAS 1254300-95-2

Catalog:	BB006120
Product Name:	7-methoxybenzo[d]thiazol-2-amine
CAS:	1254300-95-2
Synonyms:	7-methoxy-1,3-benzothiazol-2-amine; 7-methoxy-1,3-benzothiazol-2-amine

Technical Data

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Computed Properties

IUPAC Name:	7-methoxy-1,3-benzothiazol-2-amine
Description:	7-methoxybenzo[d]thiazol-2-amine (CAS# 1254300-95-2) is a useful research chemical.
Molecular Weight:	180.225
Molecular Formula:	C8H8N2OS
Canonical SMILES:	COC1=CC=CC2=C1SC(=N2)N
InChI:	InChI=1S/C8H8N2OS/c1-11-6-4-2-3-5-7(6)12-8(9)10-5/h2-4H,1H3,(H2,9,10)
InChI Key:	GXCUPRDHTOSKBC-UHFFFAOYSA-N
LogP:	1.81720

Publication Number	Title	Priority Date
US-2021047313-A1	Antitumor compound for activating jwa gene and degrading her2, preparation method thereof, and application thereof	20190812
WO-2021027045-A1	Anti-tumour compound based on jwa gene activation and her2 degradation, preparation method therefor, and use thereof	20190812
CN-110437176-B	Anti-tumor compound based on JWA gene activation and HER2 degradation, preparation method and application thereof	20190812
CN-104478828-A	2-amino-7-substituted benzothiazole compound as well as preparation method and application thereof	20141210
EP-2046896-A2	Coloured organic electrophoretic particles	20060705

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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+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:	167
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	180.03573406
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	180.03573406
Rotatable Bond Count:	1
Topological Polar Surface Area:	76.4 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2