2-[(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}pyridazin-3-yl)sulfanyl]-N-(3-chloro-4-methylphenyl)acetamide
Chemical Structure Depiction of
2-[(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}pyridazin-3-yl)sulfanyl]-N-(3-chloro-4-methylphenyl)acetamide
2-[(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}pyridazin-3-yl)sulfanyl]-N-(3-chloro-4-methylphenyl)acetamide
Compound characteristics
| Compound ID: | F814-1573 |
| Compound Name: | 2-[(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}pyridazin-3-yl)sulfanyl]-N-(3-chloro-4-methylphenyl)acetamide |
| Molecular Weight: | 442.92 |
| Molecular Formula: | C21 H19 Cl N4 O3 S |
| Smiles: | Cc1ccc(cc1[Cl])NC(CSc1ccc(NCc2ccc3c(c2)OCO3)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6645 |
| logD: | 4.6643 |
| logSw: | -4.8102 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.137 |
| InChI Key: | JBTJAGLTAWWDFQ-UHFFFAOYSA-N |