6-[4-(2H-1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-2-[4-(propan-2-yl)phenyl]pyridazin-3(2H)-one
Chemical Structure Depiction of
6-[4-(2H-1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-2-[4-(propan-2-yl)phenyl]pyridazin-3(2H)-one
6-[4-(2H-1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-2-[4-(propan-2-yl)phenyl]pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | F980-1026 |
| Compound Name: | 6-[4-(2H-1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-2-[4-(propan-2-yl)phenyl]pyridazin-3(2H)-one |
| Molecular Weight: | 446.51 |
| Molecular Formula: | C25 H26 N4 O4 |
| Smiles: | CC(C)c1ccc(cc1)N1C(C=CC(=N1)N1CCN(CC1)C(c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4519 |
| logD: | 3.4519 |
| logSw: | -3.5933 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.276 |
| InChI Key: | DJJZUPBNQNVQHT-UHFFFAOYSA-N |