1-[6-({2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}sulfanyl)pyridazin-3-yl]-N-(propan-2-yl)-1H-imidazole-4-carboxamide
Chemical Structure Depiction of
1-[6-({2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}sulfanyl)pyridazin-3-yl]-N-(propan-2-yl)-1H-imidazole-4-carboxamide
1-[6-({2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}sulfanyl)pyridazin-3-yl]-N-(propan-2-yl)-1H-imidazole-4-carboxamide
Compound characteristics
| Compound ID: | M495-1090 |
| Compound Name: | 1-[6-({2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}sulfanyl)pyridazin-3-yl]-N-(propan-2-yl)-1H-imidazole-4-carboxamide |
| Molecular Weight: | 440.48 |
| Molecular Formula: | C20 H20 N6 O4 S |
| Smiles: | CC(C)NC(c1cn(cn1)c1ccc(nn1)SCC(Nc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2336 |
| logD: | 2.2335 |
| logSw: | -2.8421 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.696 |
| InChI Key: | NSOWGBNBXCGMML-UHFFFAOYSA-N |