N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-3-(4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Chemical Structure Depiction of
N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-3-(4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-3-(4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Compound characteristics
| Compound ID: | C448-1161 |
| Compound Name: | N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-3-(4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide |
| Molecular Weight: | 554.62 |
| Molecular Formula: | C31 H31 F N6 O3 |
| Smiles: | Cn1c2C(N(c3ccc(cc3)OC)N=C(C(NCCN3CCN(CC3)c3ccccc3F)=O)c2c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7472 |
| logD: | 3.7273 |
| logSw: | -4.2741 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.711 |
| InChI Key: | BUBFXBZUGVHYOJ-UHFFFAOYSA-N |