6-[4-(3-chloro-4-fluorobenzoyl)-1,4-diazepan-1-yl]-2-(4-methylphenyl)pyridazin-3(2H)-one
Chemical Structure Depiction of
6-[4-(3-chloro-4-fluorobenzoyl)-1,4-diazepan-1-yl]-2-(4-methylphenyl)pyridazin-3(2H)-one
6-[4-(3-chloro-4-fluorobenzoyl)-1,4-diazepan-1-yl]-2-(4-methylphenyl)pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | F977-0841 |
| Compound Name: | 6-[4-(3-chloro-4-fluorobenzoyl)-1,4-diazepan-1-yl]-2-(4-methylphenyl)pyridazin-3(2H)-one |
| Molecular Weight: | 440.9 |
| Molecular Formula: | C23 H22 Cl F N4 O2 |
| Smiles: | Cc1ccc(cc1)N1C(C=CC(=N1)N1CCCN(CC1)C(c1ccc(c(c1)[Cl])F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4228 |
| logD: | 3.4228 |
| logSw: | -3.8719 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.492 |
| InChI Key: | HSSFTUOBVUXBII-UHFFFAOYSA-N |