N-(5-chloro-2-methoxyphenyl)-2-[1-(piperidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-2-[1-(piperidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
N-(5-chloro-2-methoxyphenyl)-2-[1-(piperidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
Compound characteristics
| Compound ID: | P099-0558 |
| Compound Name: | N-(5-chloro-2-methoxyphenyl)-2-[1-(piperidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide |
| Molecular Weight: | 441.96 |
| Molecular Formula: | C24 H28 Cl N3 O3 |
| Smiles: | COc1ccc(cc1NC(CN1CCc2ccccc2C1C(N1CCCCC1)=O)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7785 |
| logD: | 3.5193 |
| logSw: | -4.2527 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.113 |
| InChI Key: | ZKCQRLSUIHEEBV-HSZRJFAPSA-N |