N-(3-chloro-4-methylphenyl)-2-[1-(piperidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-2-[1-(piperidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
N-(3-chloro-4-methylphenyl)-2-[1-(piperidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
Compound characteristics
| Compound ID: | P099-0479 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-2-[1-(piperidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide |
| Molecular Weight: | 425.96 |
| Molecular Formula: | C24 H28 Cl N3 O2 |
| Smiles: | Cc1ccc(cc1[Cl])NC(CN1CCc2ccccc2C1C(N1CCCCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9158 |
| logD: | 4.8993 |
| logSw: | -4.9019 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.181 |
| InChI Key: | HAQPBGXFCMQOIO-HSZRJFAPSA-N |