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17326-09-9 | 4H-Pyrido[1,2-a]pyrimidin-4-one, 2-hydroxy-9-methyl-
CAS No: 17326-09-9 Catalog No: AG001YQX MDL No:MFCD00749757
Product Description
Catalog Number:
AG001YQX
Chemical Name:
4H-Pyrido[1,2-a]pyrimidin-4-one, 2-hydroxy-9-methyl-
CAS Number:
17326-09-9
Molecular Formula:
C9H8N2O2
Molecular Weight:
176.1720
MDL Number:
MFCD00749757
IUPAC Name:
2-hydroxy-9-methylpyrido[1,2-a]pyrimidin-4-one
InChI:
InChI=1S/C9H8N2O2/c1-6-3-2-4-11-8(13)5-7(12)10-9(6)11/h2-5,12H,1H3
InChI Key:
KZDHTEHBHTWMIC-UHFFFAOYSA-N
SMILES:
Oc1cc(=O)n2c(n1)c(C)ccc2
NSC Number:
101323
Properties
Complexity:
388
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.059g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
176.175g/mol
Monoisotopic Mass:
176.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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