N-(3-chloro-2-methylphenyl)-2-[1-(4-methylpiperidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-2-[1-(4-methylpiperidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
N-(3-chloro-2-methylphenyl)-2-[1-(4-methylpiperidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
Compound characteristics
| Compound ID: | P099-0657 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-2-[1-(4-methylpiperidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide |
| Molecular Weight: | 439.98 |
| Molecular Formula: | C25 H30 Cl N3 O2 |
| Smiles: | CC1CCN(CC1)C(C1c2ccccc2CCN1CC(Nc1cccc(c1C)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6633 |
| logD: | 4.6418 |
| logSw: | -4.6513 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.483 |
| InChI Key: | IJTNCCYMZUGJTH-XMMPIXPASA-N |