N-(2,5-dimethylphenyl)-2-[1-(piperidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
Chemical Structure Depiction of
N-(2,5-dimethylphenyl)-2-[1-(piperidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
N-(2,5-dimethylphenyl)-2-[1-(piperidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
Compound characteristics
| Compound ID: | P099-0480 |
| Compound Name: | N-(2,5-dimethylphenyl)-2-[1-(piperidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide |
| Molecular Weight: | 405.54 |
| Molecular Formula: | C25 H31 N3 O2 |
| Smiles: | Cc1ccc(C)c(c1)NC(CN1CCc2ccccc2C1C(N1CCCCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5668 |
| logD: | 3.5665 |
| logSw: | -3.5426 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.483 |
| InChI Key: | MLNBYKAVUQBZFO-XMMPIXPASA-N |