3-(3-chloro-4-methoxyphenyl)-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Chemical Structure Depiction of
3-(3-chloro-4-methoxyphenyl)-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
3-(3-chloro-4-methoxyphenyl)-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Compound characteristics
| Compound ID: | C507-0200 |
| Compound Name: | 3-(3-chloro-4-methoxyphenyl)-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide |
| Molecular Weight: | 603.1 |
| Molecular Formula: | C32 H32 Cl F N6 O3 |
| Smiles: | Cn1c2C(N(c3ccc(c(c3)[Cl])OC)N=C(C(NCCCN3CCN(CC3)c3ccc(cc3)F)=O)c2c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2401 |
| logD: | 3.6963 |
| logSw: | -4.7559 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.099 |
| InChI Key: | JGKDZZMWAXYDDQ-UHFFFAOYSA-N |