N~4~-{[4-(methylsulfanyl)phenyl]methyl}-N~5~-(propan-2-yl)-1H-imidazole-4,5-dicarboxamide
Chemical Structure Depiction of
N~4~-{[4-(methylsulfanyl)phenyl]methyl}-N~5~-(propan-2-yl)-1H-imidazole-4,5-dicarboxamide
N~4~-{[4-(methylsulfanyl)phenyl]methyl}-N~5~-(propan-2-yl)-1H-imidazole-4,5-dicarboxamide
Compound characteristics
| Compound ID: | D675-0246 |
| Compound Name: | N~4~-{[4-(methylsulfanyl)phenyl]methyl}-N~5~-(propan-2-yl)-1H-imidazole-4,5-dicarboxamide |
| Molecular Weight: | 332.42 |
| Molecular Formula: | C16 H20 N4 O2 S |
| Smiles: | CC(C)NC(c1c(C(NCc2ccc(cc2)SC)=O)nc[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6115 |
| logD: | 1.5999 |
| logSw: | -2.373 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 70.68 |
| InChI Key: | BIOUBXXJZZGJBX-UHFFFAOYSA-N |