4-benzyl-N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]piperazine-1-carboxamide
Chemical Structure Depiction of
4-benzyl-N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]piperazine-1-carboxamide
4-benzyl-N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | E942-0069 |
| Compound Name: | 4-benzyl-N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]piperazine-1-carboxamide |
| Molecular Weight: | 418.54 |
| Molecular Formula: | C25 H30 N4 O2 |
| Smiles: | CC(C)CN1C=C(c2ccccc2C1=O)NC(N1CCN(CC1)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3147 |
| logD: | 3.0862 |
| logSw: | -3.7507 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.445 |
| InChI Key: | CNTAKGSXGPYFPO-UHFFFAOYSA-N |