3-methyl-N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]piperidine-1-carboxamide
Chemical Structure Depiction of
3-methyl-N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]piperidine-1-carboxamide
3-methyl-N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]piperidine-1-carboxamide
Compound characteristics
| Compound ID: | E942-0044 |
| Compound Name: | 3-methyl-N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]piperidine-1-carboxamide |
| Molecular Weight: | 341.45 |
| Molecular Formula: | C20 H27 N3 O2 |
| Smiles: | CC(C)CN1C=C(c2ccccc2C1=O)NC(N1CCCC(C)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3713 |
| logD: | 3.3574 |
| logSw: | -3.8229 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.838 |
| InChI Key: | NUTJZLVIMNVJIK-HNNXBMFYSA-N |