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851191-03-2 | 4(3H)-Quinazolinone, 2-[1-(4-chlorophenyl)-2-methylpropyl]-3-phenyl-
CAS No: 851191-03-2 Catalog No: AG004R9H MDL No:
Product Description
Catalog Number:
AG004R9H
Chemical Name:
4(3H)-Quinazolinone, 2-[1-(4-chlorophenyl)-2-methylpropyl]-3-phenyl-
CAS Number:
851191-03-2
Molecular Formula:
C24H21ClN2O
Molecular Weight:
388.8893
IUPAC Name:
2-[1-(4-chlorophenyl)-2-methylpropyl]-3-phenylquinazolin-4-one
InChI:
InChI=1S/C24H21ClN2O/c1-16(2)22(17-12-14-18(25)15-13-17)23-26-21-11-7-6-10-20(21)24(28)27(23)19-8-4-3-5-9-19/h3-16,22H,1-2H3
InChI Key:
FBQNESLLMUJZKH-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)C(c1nc2ccccc2c(=O)n1c1ccccc1)C(C)C
Properties
Complexity:
575
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
388.134g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
388.895g/mol
Monoisotopic Mass:
388.134g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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