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1443049-85-1 | 1,3,5-Triazine, 2-(4'-chloro[1,1'-biphenyl]-3-yl)-4,6-diphenyl-
CAS No: 1443049-85-1 Catalog No: AG001JAP MDL No:
Product Description
Catalog Number:
AG001JAP
Chemical Name:
1,3,5-Triazine, 2-(4'-chloro[1,1'-biphenyl]-3-yl)-4,6-diphenyl-
CAS Number:
1443049-85-1
Molecular Formula:
C27H18ClN3
Molecular Weight:
419.9049
IUPAC Name:
2-[3-(4-chlorophenyl)phenyl]-4,6-diphenyl-1,3,5-triazine
InChI:
InChI=1S/C27H18ClN3/c28-24-16-14-19(15-17-24)22-12-7-13-23(18-22)27-30-25(20-8-3-1-4-9-20)29-26(31-27)21-10-5-2-6-11-21/h1-18H
InChI Key:
NOXDCUCUJFTIHW-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)c1cccc(c1)c1nc(nc(n1)c1ccccc1)c1ccccc1
Properties
Complexity:
511
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
419.119g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
419.912g/mol
Monoisotopic Mass:
419.119g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.2
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