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Home > Pyridines > 320418-61-9
320418-61-9 | 4-hydroxy-6-(4-methoxyphenyl)-2-(pyridin-2-yl)pyrimidine-5-carbonitrile
CAS No: 320418-61-9 Catalog No: AG00IQT9 MDL No:MFCD00139742
Product Description
Catalog Number:
AG00IQT9
Chemical Name:
4-hydroxy-6-(4-methoxyphenyl)-2-(pyridin-2-yl)pyrimidine-5-carbonitrile
CAS Number:
320418-61-9
Molecular Formula:
C17H12N4O2
Molecular Weight:
304.3028
MDL Number:
MFCD00139742
IUPAC Name:
4-(4-methoxyphenyl)-6-oxo-2-pyridin-2-yl-1H-pyrimidine-5-carbonitrile
InChI:
InChI=1S/C17H12N4O2/c1-23-12-7-5-11(6-8-12)15-13(10-18)17(22)21-16(20-15)14-4-2-3-9-19-14/h2-9H,1H3,(H,20,21,22)
InChI Key:
MUZLSCFLLAGLPF-UHFFFAOYSA-N
SMILES:
N#Cc1c(O)nc(nc1c1ccc(cc1)OC)c1ccccn1
Properties
Complexity:
579
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.096g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
304.309g/mol
Monoisotopic Mass:
304.096g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
87.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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