(S)-1-(5-Bromo-4-methylpyridin-2-yl)ethanamine Hydrochloride - CAS 1628810-35-4

Catalog:	BB070978
Product Name:	(S)-1-(5-Bromo-4-methylpyridin-2-yl)ethanamine Hydrochloride
CAS:	1628810-35-4
Synonyms:	(S)-1-(5-Bromo-4-methylpyridin-2-yl)ethanamine hydrochloride; (S)-1-(5-BROMO-4-METHYLPYRIDIN-2-YL)ETHANAMINE HCL; (1S)-1-(5-bromo-4-methylpyridin-2-yl)ethanamine; hydrochloride

Technical Data

IUPAC Name:	(1S)-1-(5-bromo-4-methylpyridin-2-yl)ethanaminehydrochloride
Description:	(S)-1-(5-Bromo-4-methylpyridin-2-yl)ethanamine Hydrochloride is used in the preparation of 3-pyrimidin-4-yl-oxazolidin-2-ones as mutant IDH protein inhibitors. These inhibitors may be used in the treatment of diseases or disorders associated with such mutant IDH proteins including cell-proliferation disorders, such as cancer.
Molecular Weight:	215.09 + (36.46)
Molecular Formula:	C8H11BrN2·(HCl)
Canonical SMILES:	CC1=CC(=NC=C1Br)C(C)N.Cl
InChI:	InChI=1S/C8H11BrN2.ClH/c1-5-3-8(6(2)10)11-4-7(5)9/h3-4,6H,10H2,1-2H31H/t6-/m0./s1
InChI Key:	XNXZPUVFWDMCIG-RGMNGODLSA-N
References:	Caferro, Thomas Raymond., et al. PCT Int. Appl. (2014), WO 2014141104 A1 20140918.

Complexity:	129
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	249.98724
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	249.98724
Rotatable Bond Count:	1
Topological Polar Surface Area:	38.9Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0