N-[1-(2,4-dimethylphenyl)ethyl]-2-[1-(4-methylpiperidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
Chemical Structure Depiction of
N-[1-(2,4-dimethylphenyl)ethyl]-2-[1-(4-methylpiperidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
N-[1-(2,4-dimethylphenyl)ethyl]-2-[1-(4-methylpiperidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
Compound characteristics
| Compound ID: | P099-0757 |
| Compound Name: | N-[1-(2,4-dimethylphenyl)ethyl]-2-[1-(4-methylpiperidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide |
| Molecular Weight: | 447.62 |
| Molecular Formula: | C28 H37 N3 O2 |
| Smiles: | CC1CCN(CC1)C(C1c2ccccc2CCN1CC(NC(C)c1ccc(C)cc1C)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8661 |
| logD: | 4.8658 |
| logSw: | -4.4755 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.666 |
| InChI Key: | VWKUODNEDFVZNT-UHFFFAOYSA-N |