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89069-83-0 | 4(3H)-Pyrimidinone, 3-(3-methylphenyl)-2,6-diphenyl-
CAS No: 89069-83-0 Catalog No: AG0040AR MDL No:
Product Description
Catalog Number:
AG0040AR
Chemical Name:
4(3H)-Pyrimidinone, 3-(3-methylphenyl)-2,6-diphenyl-
CAS Number:
89069-83-0
Molecular Formula:
C23H18N2O
Molecular Weight:
338.4018
IUPAC Name:
3-(3-methylphenyl)-2,6-diphenylpyrimidin-4-one
InChI:
InChI=1S/C23H18N2O/c1-17-9-8-14-20(15-17)25-22(26)16-21(18-10-4-2-5-11-18)24-23(25)19-12-6-3-7-13-19/h2-16H,1H3
InChI Key:
ZILKYHRHAZGDCU-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)n1c(=O)cc(nc1c1ccccc1)c1ccccc1
Properties
Complexity:
567
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.142g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
338.41g/mol
Monoisotopic Mass:
338.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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