N-[2-(azepan-1-yl)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-(azepan-1-yl)ethyl]-2-{5-[(4-fluorophenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}acetamide
N-[2-(azepan-1-yl)ethyl]-2-{5-[(4-fluorophenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}acetamide
Compound characteristics
| Compound ID: | C880-2335 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-2-{5-[(4-fluorophenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}acetamide |
| Molecular Weight: | 475.57 |
| Molecular Formula: | C27 H30 F N5 O2 |
| Smiles: | C1CCCN(CC1)CCNC(CN1C(c2c(C=N1)c1ccccc1n2Cc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.395 |
| logD: | 1.9094 |
| logSw: | -3.422 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.698 |
| InChI Key: | HIRUXLLHYZCVSY-UHFFFAOYSA-N |