N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-9-methyl-2-(2-methylpropyl)-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide
Chemical Structure Depiction of
N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-9-methyl-2-(2-methylpropyl)-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide
N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-9-methyl-2-(2-methylpropyl)-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide
Compound characteristics
| Compound ID: | C237-2217 |
| Compound Name: | N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-9-methyl-2-(2-methylpropyl)-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide |
| Molecular Weight: | 517.65 |
| Molecular Formula: | C30 H36 F N5 O2 |
| Smiles: | CC(C)CN1C=C(C(NCCCN2CCN(CC2)c2ccc(cc2)F)=O)c2c3ccccc3n(C)c2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.4499 |
| logD: | 2.9061 |
| logSw: | -3.8948 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.893 |
| InChI Key: | YZRIPQSNWGJYNL-UHFFFAOYSA-N |