N-(2H-1,3-benzodioxol-5-yl)-2-{[6-(cyclohexanesulfonyl)pyridazin-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-{[6-(cyclohexanesulfonyl)pyridazin-3-yl]sulfanyl}acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-{[6-(cyclohexanesulfonyl)pyridazin-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | M043-0306 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-{[6-(cyclohexanesulfonyl)pyridazin-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 435.52 |
| Molecular Formula: | C19 H21 N3 O5 S2 |
| Smiles: | C1CCC(CC1)S(c1ccc(nn1)SCC(Nc1ccc2c(c1)OCO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2122 |
| logD: | 3.2121 |
| logSw: | -3.4803 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.803 |
| InChI Key: | MQMONVYODOAJEM-UHFFFAOYSA-N |