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28751-92-0 | 4(1H)-Quinazolinone, 7-phenyl-1-(2-propen-1-yl)-
CAS No: 28751-92-0 Catalog No: AG002WDE MDL No:
Product Description
Catalog Number:
AG002WDE
Chemical Name:
4(1H)-Quinazolinone, 7-phenyl-1-(2-propen-1-yl)-
CAS Number:
28751-92-0
Molecular Formula:
C17H14N2O
Molecular Weight:
262.3059
IUPAC Name:
7-phenyl-1-prop-2-enylquinazolin-4-one
InChI:
InChI=1S/C17H14N2O/c1-2-10-19-12-18-17(20)15-9-8-14(11-16(15)19)13-6-4-3-5-7-13/h2-9,11-12H,1,10H2
InChI Key:
KIVFMRPITGXTFW-UHFFFAOYSA-N
SMILES:
C=CCn1cnc(=O)c2c1cc(cc2)c1ccccc1
Properties
Complexity:
398
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.111g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.312g/mol
Monoisotopic Mass:
262.111g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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