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16112-44-0 | Quinazoline, 2-(4-methylphenyl)-4-phenyl-
CAS No: 16112-44-0 Catalog No: AG001S73 MDL No:
Product Description
Catalog Number:
AG001S73
Chemical Name:
Quinazoline, 2-(4-methylphenyl)-4-phenyl-
CAS Number:
16112-44-0
Molecular Formula:
C21H16N2
Molecular Weight:
296.3651
IUPAC Name:
2-(4-methylphenyl)-4-phenylquinazoline
InChI:
InChI=1S/C21H16N2/c1-15-11-13-17(14-12-15)21-22-19-10-6-5-9-18(19)20(23-21)16-7-3-2-4-8-16/h2-14H,1H3
InChI Key:
BHDMLWMBGYVTQM-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)c1nc2ccccc2c(n1)c1ccccc1
Properties
Complexity:
368
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.131g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.373g/mol
Monoisotopic Mass:
296.131g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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