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89838-78-8 | 2H-Imidazol-2-one, 4,5-bis(4-chlorophenyl)-1,3-dihydro-1-phenyl-
CAS No: 89838-78-8 Catalog No: AG003XET MDL No:
Product Description
Catalog Number:
AG003XET
Chemical Name:
2H-Imidazol-2-one, 4,5-bis(4-chlorophenyl)-1,3-dihydro-1-phenyl-
CAS Number:
89838-78-8
Molecular Formula:
C21H14Cl2N2O
Molecular Weight:
381.2547
IUPAC Name:
4,5-bis(4-chlorophenyl)-3-phenyl-1H-imidazol-2-one
InChI:
InChI=1S/C21H14Cl2N2O/c22-16-10-6-14(7-11-16)19-20(15-8-12-17(23)13-9-15)25(21(26)24-19)18-4-2-1-3-5-18/h1-13H,(H,24,26)
InChI Key:
BWLPBGHFKALLAI-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)c1c([nH]c(=O)n1c1ccccc1)c1ccc(cc1)Cl
Properties
Complexity:
542
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
380.048g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
381.256g/mol
Monoisotopic Mass:
380.048g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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