N-(3-chlorophenyl)-2-[1-(pyrrolidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-2-[1-(pyrrolidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
N-(3-chlorophenyl)-2-[1-(pyrrolidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
Compound characteristics
| Compound ID: | P099-0298 |
| Compound Name: | N-(3-chlorophenyl)-2-[1-(pyrrolidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide |
| Molecular Weight: | 397.9 |
| Molecular Formula: | C22 H24 Cl N3 O2 |
| Smiles: | C1CCN(C1)C(C1c2ccccc2CCN1CC(Nc1cccc(c1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0639 |
| logD: | 4.0513 |
| logSw: | -4.3435 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.546 |
| InChI Key: | BSVFSWOMSLJASI-OAQYLSRUSA-N |