N-(2H-1,3-benzodioxol-5-yl)-2-[(6-{[(4-chlorophenyl)methyl]amino}pyridazin-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-[(6-{[(4-chlorophenyl)methyl]amino}pyridazin-3-yl)sulfanyl]acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-[(6-{[(4-chlorophenyl)methyl]amino}pyridazin-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | F814-1422 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-[(6-{[(4-chlorophenyl)methyl]amino}pyridazin-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 428.9 |
| Molecular Formula: | C20 H17 Cl N4 O3 S |
| Smiles: | C(c1ccc(cc1)[Cl])Nc1ccc(nn1)SCC(Nc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7891 |
| logD: | 3.789 |
| logSw: | -4.373 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.137 |
| InChI Key: | UPVPJJDQGQYLMR-UHFFFAOYSA-N |