methyl 1-[6-({2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}sulfanyl)pyridazin-3-yl]-1H-imidazole-4-carboxylate
Chemical Structure Depiction of
methyl 1-[6-({2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}sulfanyl)pyridazin-3-yl]-1H-imidazole-4-carboxylate
methyl 1-[6-({2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}sulfanyl)pyridazin-3-yl]-1H-imidazole-4-carboxylate
Compound characteristics
| Compound ID: | M494-0825 |
| Compound Name: | methyl 1-[6-({2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}sulfanyl)pyridazin-3-yl]-1H-imidazole-4-carboxylate |
| Molecular Weight: | 437.4 |
| Molecular Formula: | C18 H14 F3 N5 O3 S |
| Smiles: | COC(c1cn(cn1)c1ccc(nn1)SCC(Nc1ccccc1C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6792 |
| logD: | 2.6791 |
| logSw: | -3.29 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.398 |
| InChI Key: | XQXHUJHIJIAYPT-UHFFFAOYSA-N |