[(2-chloro-1,3-thiazol-5-yl)methyl](methyl)amine - CAS 120740-06-9

Catalog:	BB004955
Product Name:	[(2-chloro-1,3-thiazol-5-yl)methyl](methyl)amine
CAS:	120740-06-9
Synonyms:	1-(2-chloro-5-thiazolyl)-N-methylmethanamine; 1-(2-chloro-1,3-thiazol-5-yl)-N-methylmethanamine

Technical Data

Patents

Computed Properties

IUPAC Name:	1-(2-chloro-1,3-thiazol-5-yl)-N-methylmethanamine
Description:	[(2-chloro-1,3-thiazol-5-yl)methyl](methyl)amine (CAS# 120740-06-9) is a useful research chemical.
Molecular Weight:	162.635
Molecular Formula:	C5H7ClN2S
Canonical SMILES:	CNCC1=CN=C(S1)Cl
InChI:	InChI=1S/C5H7ClN2S/c1-7-2-4-3-8-5(6)9-4/h3,7H,2H2,1H3
InChI Key:	SMWPUJJZPVUXMC-UHFFFAOYSA-N
MDL:	MFCD18206726
LogP:	1.90680

Publication Number	Title	Priority Date
CN-109485644-B	Substituted benzisothiazole compound and preparation method and application thereof	20170912
EP-3424905-A1	Heterocyclic compound	20160229
US-2019040038-A1	Heterocyclic compound	20160229
US-11124492-B2	Heterocyclic compound	20160229
EP-3349580-A1	Hepatitis b core protein modulators	20150915

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Related Functional Groups

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Complexity:	91
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	162.0018471
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	162.0018471
Rotatable Bond Count:	2
Topological Polar Surface Area:	53.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.3