N-[1-(2,4-dimethylphenyl)ethyl]-2-[1-(pyrrolidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
Chemical Structure Depiction of
N-[1-(2,4-dimethylphenyl)ethyl]-2-[1-(pyrrolidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
N-[1-(2,4-dimethylphenyl)ethyl]-2-[1-(pyrrolidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
Compound characteristics
| Compound ID: | P099-0407 |
| Compound Name: | N-[1-(2,4-dimethylphenyl)ethyl]-2-[1-(pyrrolidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide |
| Molecular Weight: | 419.57 |
| Molecular Formula: | C26 H33 N3 O2 |
| Smiles: | CC(c1ccc(C)cc1C)NC(CN1CCc2ccccc2C1C(N1CCCC1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3205 |
| logD: | 4.3198 |
| logSw: | -4.1866 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.032 |
| InChI Key: | GLRVVZPGYJKNEX-UHFFFAOYSA-N |