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874009-85-5 | 1H-Benzimidazole, 2-[2-(phenylmethoxy)phenyl]-1-(phenylmethyl)-
CAS No: 874009-85-5 Catalog No: AG004GP9 MDL No:
Product Description
Catalog Number:
AG004GP9
Chemical Name:
1H-Benzimidazole, 2-[2-(phenylmethoxy)phenyl]-1-(phenylmethyl)-
CAS Number:
874009-85-5
Molecular Formula:
C27H22N2O
Molecular Weight:
390.4764
IUPAC Name:
1-benzyl-2-(2-phenylmethoxyphenyl)benzimidazole
InChI:
InChI=1S/C27H22N2O/c1-3-11-21(12-4-1)19-29-25-17-9-8-16-24(25)28-27(29)23-15-7-10-18-26(23)30-20-22-13-5-2-6-14-22/h1-18H,19-20H2
InChI Key:
XXAMTGPBNZGJES-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)COc1ccccc1c1nc2c(n1Cc1ccccc1)cccc2
Properties
Complexity:
513
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
390.173g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
390.486g/mol
Monoisotopic Mass:
390.173g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2
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