3-[2-(azepan-1-yl)-2-oxoethyl]-5-[(4-methylphenyl)methyl]-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
Chemical Structure Depiction of
3-[2-(azepan-1-yl)-2-oxoethyl]-5-[(4-methylphenyl)methyl]-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
3-[2-(azepan-1-yl)-2-oxoethyl]-5-[(4-methylphenyl)methyl]-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
Compound characteristics
| Compound ID: | C795-0237 |
| Compound Name: | 3-[2-(azepan-1-yl)-2-oxoethyl]-5-[(4-methylphenyl)methyl]-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one |
| Molecular Weight: | 428.53 |
| Molecular Formula: | C26 H28 N4 O2 |
| Smiles: | Cc1ccc(Cn2c3C(N(CC(N4CCCCCC4)=O)N=Cc3c3ccccc23)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1408 |
| logD: | 4.1408 |
| logSw: | -4.0658 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.795 |
| InChI Key: | IEVDJLFQDLTZTI-UHFFFAOYSA-N |