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1689538-58-6 | Pyrimidine, 4-[1,1'-biphenyl]-4-yl-6-chloro-2-phenyl-
CAS No: 1689538-58-6 Catalog No: AG001YE0 MDL No:MFCD29477698
Product Description
Catalog Number:
AG001YE0
Chemical Name:
Pyrimidine, 4-[1,1'-biphenyl]-4-yl-6-chloro-2-phenyl-
CAS Number:
1689538-58-6
Molecular Formula:
C22H15ClN2
Molecular Weight:
342.8209
MDL Number:
MFCD29477698
IUPAC Name:
4-chloro-2-phenyl-6-(4-phenylphenyl)pyrimidine
InChI:
InChI=1S/C22H15ClN2/c23-21-15-20(24-22(25-21)19-9-5-2-6-10-19)18-13-11-17(12-14-18)16-7-3-1-4-8-16/h1-15H
InChI Key:
JWWMUTCXVNBWGP-UHFFFAOYSA-N
SMILES:
Clc1cc(nc(n1)c1ccccc1)c1ccc(cc1)c1ccccc1
Properties
Complexity:
395
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.092g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
342.826g/mol
Monoisotopic Mass:
342.092g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.1
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