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72923-17-2 | 2(1H)-Pyrimidinone, 1-(4-methylphenyl)-4,6-diphenyl-
CAS No: 72923-17-2 Catalog No: AG005DZG MDL No:
Product Description
Catalog Number:
AG005DZG
Chemical Name:
2(1H)-Pyrimidinone, 1-(4-methylphenyl)-4,6-diphenyl-
CAS Number:
72923-17-2
Molecular Formula:
C23H18N2O
Molecular Weight:
338.4018
IUPAC Name:
1-(4-methylphenyl)-4,6-diphenylpyrimidin-2-one
InChI:
InChI=1S/C23H18N2O/c1-17-12-14-20(15-13-17)25-22(19-10-6-3-7-11-19)16-21(24-23(25)26)18-8-4-2-5-9-18/h2-16H,1H3
InChI Key:
XEIAFVUDGFSBCF-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)n1c(=O)nc(cc1c1ccccc1)c1ccccc1
Properties
Complexity:
559
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:
1
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:
5
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