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Home > Imidazoles > 159557-23-0
159557-23-0 | 1H-Benzimidazole, 2-[[4-(phenylmethyl)-1-piperidinyl]methyl]-
CAS No: 159557-23-0 Catalog No: AG001R5O MDL No:
Product Description
Catalog Number:
AG001R5O
Chemical Name:
1H-Benzimidazole, 2-[[4-(phenylmethyl)-1-piperidinyl]methyl]-
CAS Number:
159557-23-0
Molecular Formula:
C20H23N3
Molecular Weight:
305.4167
IUPAC Name:
2-[(4-benzylpiperidin-1-yl)methyl]-1H-benzimidazole
InChI:
InChI=1S/C20H23N3/c1-2-6-16(7-3-1)14-17-10-12-23(13-11-17)15-20-21-18-8-4-5-9-19(18)22-20/h1-9,17H,10-15H2,(H,21,22)
InChI Key:
WHMKZOBPYPISHR-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CC1CCN(CC1)Cc1nc2c([nH]1)cccc2
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.189g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
305.425g/mol
Monoisotopic Mass:
305.189g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
31.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
Literature
| Title | Journal |
|---|---|
| NR2B-selective N-methyl-D-aspartate antagonists: synthesis and evaluation of 5-substituted benzimidazoles. | Journal of medicinal chemistry 20040408 |
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