N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-9-methyl-2-(2-methylpropyl)-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide
Chemical Structure Depiction of
N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-9-methyl-2-(2-methylpropyl)-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide
N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-9-methyl-2-(2-methylpropyl)-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide
Compound characteristics
| Compound ID: | C237-2234 |
| Compound Name: | N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-9-methyl-2-(2-methylpropyl)-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide |
| Molecular Weight: | 520.07 |
| Molecular Formula: | C29 H34 Cl N5 O2 |
| Smiles: | CC(C)CN1C=C(C(NCCN2CCN(CC2)c2cccc(c2)[Cl])=O)c2c3ccccc3n(C)c2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.7597 |
| logD: | 3.5799 |
| logSw: | -4.6675 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.893 |
| InChI Key: | JSTOTZQWLDHXND-UHFFFAOYSA-N |