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918892-35-0 | 1H-Imidazole, 1-[(2-iodophenyl)methyl]-5-(2-methylpropyl)-4-phenyl-
CAS No: 918892-35-0 Catalog No: AG006MGM MDL No:
Product Description
Catalog Number:
AG006MGM
Chemical Name:
1H-Imidazole, 1-[(2-iodophenyl)methyl]-5-(2-methylpropyl)-4-phenyl-
CAS Number:
918892-35-0
Molecular Formula:
C20H21IN2
Molecular Weight:
416.2986
IUPAC Name:
1-[(2-iodophenyl)methyl]-5-(2-methylpropyl)-4-phenylimidazole
InChI:
InChI=1S/C20H21IN2/c1-15(2)12-19-20(16-8-4-3-5-9-16)22-14-23(19)13-17-10-6-7-11-18(17)21/h3-11,14-15H,12-13H2,1-2H3
InChI Key:
BJBALLHRQBTNDN-UHFFFAOYSA-N
SMILES:
CC(Cc1n(cnc1c1ccccc1)Cc1ccccc1I)C
Properties
Complexity:
354
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
416.075g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
416.306g/mol
Monoisotopic Mass:
416.075g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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