2-{5-[(4-fluorophenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide
Chemical Structure Depiction of
2-{5-[(4-fluorophenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide
2-{5-[(4-fluorophenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide
Compound characteristics
| Compound ID: | C880-2329 |
| Compound Name: | 2-{5-[(4-fluorophenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide |
| Molecular Weight: | 490.58 |
| Molecular Formula: | C27 H31 F N6 O2 |
| Smiles: | CN1CCN(CCCNC(CN2C(c3c(C=N2)c2ccccc2n3Cc2ccc(cc2)F)=O)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 1.8286 |
| logD: | 0.6241 |
| logSw: | -2.4537 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.844 |
| InChI Key: | BHLXKOXXJQHNBU-UHFFFAOYSA-N |