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89374-16-3

89374-16-3 | Methanone, [3,5-diphenyl-1-(3-quinolinyl)-1H-pyrrol-2-yl]phenyl-

CAS No: 89374-16-3 Catalog No: AG006949 MDL No:

Product Description

Catalog Number:
AG006949
Chemical Name:
Methanone, [3,5-diphenyl-1-(3-quinolinyl)-1H-pyrrol-2-yl]phenyl-
CAS Number:
89374-16-3
Molecular Formula:
C32H22N2O
Molecular Weight:
450.5299
IUPAC Name:
(3,5-diphenyl-1-quinolin-3-ylpyrrol-2-yl)-phenylmethanone
InChI:
InChI=1S/C32H22N2O/c35-32(25-16-8-3-9-17-25)31-28(23-12-4-1-5-13-23)21-30(24-14-6-2-7-15-24)34(31)27-20-26-18-10-11-19-29(26)33-22-27/h1-22H
InChI Key:
AULHHXVHPIEXLS-UHFFFAOYSA-N
SMILES:
O=C(c1n(c2cnc3c(c2)cccc3)c(cc1c1ccccc1)c1ccccc1)c1ccccc1

Properties

Complexity:
690  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
450.173g/mol
Formal Charge:
0
Heavy Atom Count:
35  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
450.541g/mol
Monoisotopic Mass:
450.173g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.6  

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