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1013916-37-4 | Pyrido[2,3-d]pyrimidin-7(8H)-one, 2-chloro-8-cyclopentyl-5-methyl-
CAS No: 1013916-37-4 Catalog No: AG0004D8 MDL No:MFCD13181207
Product Description
Catalog Number:
AG0004D8
Chemical Name:
Pyrido[2,3-d]pyrimidin-7(8H)-one, 2-chloro-8-cyclopentyl-5-methyl-
CAS Number:
1013916-37-4
Molecular Formula:
C13H14ClN3O
Molecular Weight:
263.7228
MDL Number:
MFCD13181207
IUPAC Name:
2-chloro-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one
InChI:
InChI=1S/C13H14ClN3O/c1-8-6-11(18)17(9-4-2-3-5-9)12-10(8)7-15-13(14)16-12/h6-7,9H,2-5H2,1H3
InChI Key:
BSKNQSYIDZUXQT-UHFFFAOYSA-N
SMILES:
Clc1ncc2c(n1)n(C1CCCC1)c(=O)cc2C
EC Number:
800-066-8
Properties
Complexity:
378
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.083g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.725g/mol
Monoisotopic Mass:
263.083g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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