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Home > Pyridines > 1468566-61-1
1468566-61-1 | 2-(pyridin-2-yl)-3H,4H,5H,6H,7H,8H-pyrido[2,3-d]pyrimidin-4-one
CAS No: 1468566-61-1 Catalog No: AG01C453 MDL No:MFCD18631467
Product Description
Catalog Number:
AG01C453
Chemical Name:
2-(pyridin-2-yl)-3H,4H,5H,6H,7H,8H-pyrido[2,3-d]pyrimidin-4-one
CAS Number:
1468566-61-1
Molecular Formula:
C12H12N4O
Molecular Weight:
228.2499
MDL Number:
MFCD18631467
IUPAC Name:
2-pyridin-2-yl-5,6,7,8-tetrahydro-3H-pyrido[2,3-d]pyrimidin-4-one
InChI:
InChI=1S/C12H12N4O/c17-12-8-4-3-7-14-10(8)15-11(16-12)9-5-1-2-6-13-9/h1-2,5-6H,3-4,7H2,(H2,14,15,16,17)
InChI Key:
NIFGDBSJNJMWPO-UHFFFAOYSA-N
SMILES:
O=c1[nH]c(nc2c1CCCN2)c1ccccn1
Properties
Complexity:
399
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.101g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
228.255g/mol
Monoisotopic Mass:
228.101g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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