N-{[4-(propan-2-yl)phenyl]methyl}-2-[1-(pyrrolidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
Chemical Structure Depiction of
N-{[4-(propan-2-yl)phenyl]methyl}-2-[1-(pyrrolidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
N-{[4-(propan-2-yl)phenyl]methyl}-2-[1-(pyrrolidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide
Compound characteristics
| Compound ID: | P099-0437 |
| Compound Name: | N-{[4-(propan-2-yl)phenyl]methyl}-2-[1-(pyrrolidine-1-carbonyl)-3,4-dihydroisoquinolin-2(1H)-yl]acetamide |
| Molecular Weight: | 419.57 |
| Molecular Formula: | C26 H33 N3 O2 |
| Smiles: | CC(C)c1ccc(CNC(CN2CCc3ccccc3C2C(N2CCCC2)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2263 |
| logD: | 4.2257 |
| logSw: | -4.0467 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.869 |
| InChI Key: | OIBLNSABNUHSID-RUZDIDTESA-N |