N-(2H-1,3-benzodioxol-5-yl)-2-({6-[4-(4-fluorophenyl)piperazin-1-yl]pyridazin-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-({6-[4-(4-fluorophenyl)piperazin-1-yl]pyridazin-3-yl}sulfanyl)acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-({6-[4-(4-fluorophenyl)piperazin-1-yl]pyridazin-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | L383-0135 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-({6-[4-(4-fluorophenyl)piperazin-1-yl]pyridazin-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 467.52 |
| Molecular Formula: | C23 H22 F N5 O3 S |
| Smiles: | C1CN(CCN1c1ccc(cc1)F)c1ccc(nn1)SCC(Nc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9896 |
| logD: | 3.9896 |
| logSw: | -4.1291 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.512 |
| InChI Key: | XAXYANJDINRKGG-UHFFFAOYSA-N |