6-[4-(2H-1,3-benzodioxole-5-carbonyl)-1,4-diazepan-1-yl]-2-(4-methylphenyl)pyridazin-3(2H)-one
Chemical Structure Depiction of
6-[4-(2H-1,3-benzodioxole-5-carbonyl)-1,4-diazepan-1-yl]-2-(4-methylphenyl)pyridazin-3(2H)-one
6-[4-(2H-1,3-benzodioxole-5-carbonyl)-1,4-diazepan-1-yl]-2-(4-methylphenyl)pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | F977-0755 |
| Compound Name: | 6-[4-(2H-1,3-benzodioxole-5-carbonyl)-1,4-diazepan-1-yl]-2-(4-methylphenyl)pyridazin-3(2H)-one |
| Molecular Weight: | 432.48 |
| Molecular Formula: | C24 H24 N4 O4 |
| Smiles: | Cc1ccc(cc1)N1C(C=CC(=N1)N1CCCN(CC1)C(c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8053 |
| logD: | 2.8053 |
| logSw: | -3.1646 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.607 |
| InChI Key: | OACWTMIBOAXPPX-UHFFFAOYSA-N |