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126245-15-6 | 4H-Imidazol-4-one, 5-[(4-bromophenyl)methylene]-3-[[(2-chlorophenyl)methylene]amino]-3,5-dihydro-2-phenyl-
CAS No: 126245-15-6 Catalog No: AG000SF8 MDL No:
Product Description
Catalog Number:
AG000SF8
Chemical Name:
4H-Imidazol-4-one, 5-[(4-bromophenyl)methylene]-3-[[(2-chlorophenyl)methylene]amino]-3,5-dihydro-2-phenyl-
CAS Number:
126245-15-6
Molecular Formula:
C23H15BrClN3O
Molecular Weight:
464.7417
IUPAC Name:
5-[(4-bromophenyl)methylidene]-3-[(2-chlorophenyl)methylideneamino]-2-phenylimidazol-4-one
InChI:
InChI=1S/C23H15BrClN3O/c24-19-12-10-16(11-13-19)14-21-23(29)28(22(27-21)17-6-2-1-3-7-17)26-15-18-8-4-5-9-20(18)25/h1-15H
InChI Key:
VKXIUXNIQXZVAI-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)C=C1N=C(N(C1=O)N=Cc1ccccc1Cl)c1ccccc1
Properties
Complexity:
678
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
463.009g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
464.747g/mol
Monoisotopic Mass:
463.009g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
45A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
6.1
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