N-{2-[cyclohexyl(methyl)amino]ethyl}-2-{5-[(4-fluorophenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}acetamide
Chemical Structure Depiction of
N-{2-[cyclohexyl(methyl)amino]ethyl}-2-{5-[(4-fluorophenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}acetamide
N-{2-[cyclohexyl(methyl)amino]ethyl}-2-{5-[(4-fluorophenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}acetamide
Compound characteristics
| Compound ID: | C880-2345 |
| Compound Name: | N-{2-[cyclohexyl(methyl)amino]ethyl}-2-{5-[(4-fluorophenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}acetamide |
| Molecular Weight: | 489.59 |
| Molecular Formula: | C28 H32 F N5 O2 |
| Smiles: | CN(CCNC(CN1C(c2c(C=N1)c1ccccc1n2Cc1ccc(cc1)F)=O)=O)C1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 3.6407 |
| logD: | 2.1995 |
| logSw: | -3.8357 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.422 |
| InChI Key: | IUWNORPUFFMNIS-UHFFFAOYSA-N |