N-methyl-1-(6-{[2-oxo-2-({[4-(trifluoromethyl)phenyl]methyl}amino)ethyl]sulfanyl}pyridazin-3-yl)-1H-imidazole-4-carboxamide
Chemical Structure Depiction of
N-methyl-1-(6-{[2-oxo-2-({[4-(trifluoromethyl)phenyl]methyl}amino)ethyl]sulfanyl}pyridazin-3-yl)-1H-imidazole-4-carboxamide
N-methyl-1-(6-{[2-oxo-2-({[4-(trifluoromethyl)phenyl]methyl}amino)ethyl]sulfanyl}pyridazin-3-yl)-1H-imidazole-4-carboxamide
Compound characteristics
| Compound ID: | M495-0981 |
| Compound Name: | N-methyl-1-(6-{[2-oxo-2-({[4-(trifluoromethyl)phenyl]methyl}amino)ethyl]sulfanyl}pyridazin-3-yl)-1H-imidazole-4-carboxamide |
| Molecular Weight: | 450.44 |
| Molecular Formula: | C19 H17 F3 N6 O2 S |
| Smiles: | CNC(c1cn(cn1)c1ccc(nn1)SCC(NCc1ccc(cc1)C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1525 |
| logD: | 2.1525 |
| logSw: | -2.4335 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.079 |
| InChI Key: | MPLQSMDAGDDMGM-UHFFFAOYSA-N |