2-[(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}pyridazin-3-yl)sulfanyl]-N-[(2-bromophenyl)methyl]acetamide
Chemical Structure Depiction of
2-[(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}pyridazin-3-yl)sulfanyl]-N-[(2-bromophenyl)methyl]acetamide
2-[(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}pyridazin-3-yl)sulfanyl]-N-[(2-bromophenyl)methyl]acetamide
Compound characteristics
| Compound ID: | F814-1637 |
| Compound Name: | 2-[(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}pyridazin-3-yl)sulfanyl]-N-[(2-bromophenyl)methyl]acetamide |
| Molecular Weight: | 487.37 |
| Molecular Formula: | C21 H19 Br N4 O3 S |
| Smiles: | C(c1ccc2c(c1)OCO2)Nc1ccc(nn1)SCC(NCc1ccccc1[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.8277 |
| logD: | 3.8277 |
| logSw: | -4.0314 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.46 |
| InChI Key: | CVWBNNZFKCRCRD-UHFFFAOYSA-N |