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Home > Imidazoles > 89521-57-3
89521-57-3 | Methanone, phenyl[4-(phenylmethoxy)-1H-benzimidazol-2-yl]-
CAS No: 89521-57-3 Catalog No: AG003ZUQ MDL No:
Product Description
Catalog Number:
AG003ZUQ
Chemical Name:
Methanone, phenyl[4-(phenylmethoxy)-1H-benzimidazol-2-yl]-
CAS Number:
89521-57-3
Molecular Formula:
C21H16N2O2
Molecular Weight:
328.3639
IUPAC Name:
phenyl-(4-phenylmethoxy-1H-benzimidazol-2-yl)methanone
InChI:
InChI=1S/C21H16N2O2/c24-20(16-10-5-2-6-11-16)21-22-17-12-7-13-18(19(17)23-21)25-14-15-8-3-1-4-9-15/h1-13H,14H2,(H,22,23)
InChI Key:
XYBLEJKLOQJSMK-UHFFFAOYSA-N
SMILES:
O=C(c1nc2c([nH]1)cccc2OCc1ccccc1)c1ccccc1
Properties
Complexity:
443
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.121g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
328.371g/mol
Monoisotopic Mass:
328.121g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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