N-[3-(azepan-1-yl)propyl]-1-{1-[(2,5-dimethylphenyl)methyl]-1H-benzimidazol-2-yl}piperidine-4-carboxamide
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-1-{1-[(2,5-dimethylphenyl)methyl]-1H-benzimidazol-2-yl}piperidine-4-carboxamide
N-[3-(azepan-1-yl)propyl]-1-{1-[(2,5-dimethylphenyl)methyl]-1H-benzimidazol-2-yl}piperidine-4-carboxamide
Compound characteristics
Compound ID: | C797-0519 |
Compound Name: | N-[3-(azepan-1-yl)propyl]-1-{1-[(2,5-dimethylphenyl)methyl]-1H-benzimidazol-2-yl}piperidine-4-carboxamide |
Molecular Weight: | 501.72 |
Molecular Formula: | C31 H43 N5 O |
Smiles: | Cc1ccc(C)c(Cn2c3ccccc3nc2N2CCC(CC2)C(NCCCN2CCCCCC2)=O)c1 |
Stereo: | ACHIRAL |
logP: | 6.1 |
logD: | 3.4713 |
logSw: | -5.1901 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 41.729 |
InChI Key: | PEZXFVLDOHYLEF-UHFFFAOYSA-N |