4-(2-fluorophenyl)-N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]piperazine-1-carboxamide
Chemical Structure Depiction of
4-(2-fluorophenyl)-N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]piperazine-1-carboxamide
4-(2-fluorophenyl)-N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | E942-0035 |
| Compound Name: | 4-(2-fluorophenyl)-N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]piperazine-1-carboxamide |
| Molecular Weight: | 422.5 |
| Molecular Formula: | C24 H27 F N4 O2 |
| Smiles: | CC(C)CN1C=C(c2ccccc2C1=O)NC(N1CCN(CC1)c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8122 |
| logD: | 3.7983 |
| logSw: | -4.0366 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.864 |
| InChI Key: | SPJXTKPARQSLIM-UHFFFAOYSA-N |