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Home > Other Building Blocks > 88317-16-2
88317-16-2 | 4(1H)-Pyrimidinone, 1-ethyl-2,5,6-triphenyl-
CAS No: 88317-16-2 Catalog No: AG0048H3 MDL No:
Product Description
Catalog Number:
AG0048H3
Chemical Name:
4(1H)-Pyrimidinone, 1-ethyl-2,5,6-triphenyl-
CAS Number:
88317-16-2
Molecular Formula:
C24H20N2O
Molecular Weight:
352.4284
IUPAC Name:
1-ethyl-2,5,6-triphenylpyrimidin-4-one
InChI:
InChI=1S/C24H20N2O/c1-2-26-22(19-14-8-4-9-15-19)21(18-12-6-3-7-13-18)24(27)25-23(26)20-16-10-5-11-17-20/h3-17H,2H2,1H3
InChI Key:
VRPBSUKAXZDGRO-UHFFFAOYSA-N
SMILES:
CCn1c(nc(=O)c(c1c1ccccc1)c1ccccc1)c1ccccc1
Properties
Complexity:
588
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
352.158g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
352.437g/mol
Monoisotopic Mass:
352.158g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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