AG00053Y

1016636-76-2 | Pyrido[2,3-d]pyrimidin-7(8H)-one, 6-bromo-2-chloro-8-cyclopentyl-5-methyl-

AG00053Y

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CAS Number	1016636-76-2
Catalog Number	AG00053Y(AGN-PC-0WAG3M)
Chemical Name	Pyrido[2,3-d]pyrimidin-7(8H)-one, 6-bromo-2-chloro-8-cyclopentyl-5-methyl-
EC Number	800-433-2
IUPAC Name	6-bromo-2-chloro-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one
InChI	InChI=1S/C13H13BrClN3O/c1-7-9-6-16-13(15)17-11(9)18(12(19)10(7)14)8-4-2-3-5-8/h6,8H,2-5H2,1H3
InChI Key	HJQCAEDIUJXGCQ-UHFFFAOYSA-N
MDL Number	MFCD13181208
Molecular Formula	C13H13BrClN3O
Molecular Weight	342.6188
SMILES	Clc1ncc2c(n1)n(C1CCCC1)c(=O)c(c2C)Br
Synonyms	1016636-76-2, 6-Bromo-2-chloro-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7(8H)-one, 6-Bromo-2-chloro-8-cyclopentyl-5-methyl-7H,8H-pyrido[2,3-d]pyrimidin-7-one, MFCD13181208, AK-79762, Pyrido[2,3-d]pyrimidin-7(8H)-one, 6-bromo-2-chloro-8-cyclopentyl-5-methyl-, HJQCAEDIUJXGCQ-UHFFFAOYSA-N, C13H13BrClN3O, PD0332991 Isethiote, SCHEMBL13202803, CTK8C2408, DTXSID10658036, BCP09136, CS-B0329, 0432AA, ANW-68350, ZINC85223586, AKOS016007219, ACN-036224, CM11095, CM14179, QC-4423, SB17740, KS-0000066O, AC-29707, AS-10041, SC-92313, SY058791, AJ-127246, AX8237547, TC-157095, FT-0697067, FT-0697068, ST24045150, MFCD13181208 (97%), 6-broMo-2-chloro-8-cyclopentyl-5-Methylpyrido[2,3-, 6-Bromo-2-chloro-8-cyclopentyl-5-methyl-8H-pyrido[2,3-d]pyrimidin-7-one, 6-Bromo-2-chloro-8-cyclopentyl-5-methylpyrido-[2,3-d]pyrimidin-7(8H)-one, 6-bromo-2-chloro-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one, 6-Bromo-2-chloro-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7(8H)-one, AldrichCPR, Pyrido[2,3-d]pyrimidin-7(8H)-one,6-bromo-2-chloro-8-cyclopentyl-5-methyl-, 6-Bromo-2-chloro-8-cyclopentyl-5-methyl-8H-pyrido[2,3-d]pyrimidin-7-one - 5G 5g, 6-BROMO-2-CHLORO-8-CYCLOPENTYL-5-METHYL-PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONE,

Complexity	422
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	340.993g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	342.621g/mol
Monoisotopic Mass	340.993g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	46.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H317-H319
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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