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69932-55-4 | Pyrido[2,3-d]pyrimidin-4(1H)-one, 2-methyl-5,7-diphenyl-
CAS No: 69932-55-4 Catalog No: AG0065NX MDL No:
Product Description
Catalog Number:
AG0065NX
Chemical Name:
Pyrido[2,3-d]pyrimidin-4(1H)-one, 2-methyl-5,7-diphenyl-
CAS Number:
69932-55-4
Molecular Formula:
C20H15N3O
Molecular Weight:
313.3526
IUPAC Name:
2-methyl-5,7-diphenyl-3H-pyrido[2,3-d]pyrimidin-4-one
InChI:
InChI=1S/C20H15N3O/c1-13-21-19-18(20(24)22-13)16(14-8-4-2-5-9-14)12-17(23-19)15-10-6-3-7-11-15/h2-12H,1H3,(H,21,22,23,24)
InChI Key:
VTRZENUEKFDFDH-UHFFFAOYSA-N
SMILES:
Cc1nc(=O)c2c([nH]1)nc(cc2c1ccccc1)c1ccccc1
Properties
Complexity:
491
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.122g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
313.36g/mol
Monoisotopic Mass:
313.122g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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