N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-{1-[(2-methylphenyl)methyl]-1H-benzimidazol-2-yl}piperidine-4-carboxamide
Chemical Structure Depiction of
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-{1-[(2-methylphenyl)methyl]-1H-benzimidazol-2-yl}piperidine-4-carboxamide
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-{1-[(2-methylphenyl)methyl]-1H-benzimidazol-2-yl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C797-0786 |
| Compound Name: | N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-{1-[(2-methylphenyl)methyl]-1H-benzimidazol-2-yl}piperidine-4-carboxamide |
| Molecular Weight: | 521.71 |
| Molecular Formula: | C33 H39 N5 O |
| Smiles: | Cc1ccccc1Cn1c2ccccc2nc1N1CCC(CC1)C(NCCCN1CCc2ccccc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1261 |
| logD: | 4.9221 |
| logSw: | -5.3403 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.06 |
| InChI Key: | XBHHJKGQMCNKRO-UHFFFAOYSA-N |