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10198-75-1 | 6-hydroxy-5-methyl-2-(pyridin-2-yl)-3,4-dihydropyrimidin-4-one
CAS No: 10198-75-1 Catalog No: AG01BVM5 MDL No:MFCD18843876
Product Description
Catalog Number:
AG01BVM5
Chemical Name:
6-hydroxy-5-methyl-2-(pyridin-2-yl)-3,4-dihydropyrimidin-4-one
CAS Number:
10198-75-1
Molecular Formula:
C10H9N3O2
Molecular Weight:
203.1974
MDL Number:
MFCD18843876
IUPAC Name:
4-hydroxy-5-methyl-2-pyridin-2-yl-1H-pyrimidin-6-one
InChI:
InChI=1S/C10H9N3O2/c1-6-9(14)12-8(13-10(6)15)7-4-2-3-5-11-7/h2-5H,1H3,(H2,12,13,14,15)
InChI Key:
FONVMUAAGGNQEH-UHFFFAOYSA-N
SMILES:
Oc1nc([nH]c(=O)c1C)c1ccccn1
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.069g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
203.201g/mol
Monoisotopic Mass:
203.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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