N~5~-benzyl-N~4~-{[4-(methylsulfanyl)phenyl]methyl}-1H-imidazole-4,5-dicarboxamide
Chemical Structure Depiction of
N~5~-benzyl-N~4~-{[4-(methylsulfanyl)phenyl]methyl}-1H-imidazole-4,5-dicarboxamide
N~5~-benzyl-N~4~-{[4-(methylsulfanyl)phenyl]methyl}-1H-imidazole-4,5-dicarboxamide
Compound characteristics
| Compound ID: | D675-0249 |
| Compound Name: | N~5~-benzyl-N~4~-{[4-(methylsulfanyl)phenyl]methyl}-1H-imidazole-4,5-dicarboxamide |
| Molecular Weight: | 380.47 |
| Molecular Formula: | C20 H20 N4 O2 S |
| Smiles: | CSc1ccc(CNC(c2c(C(NCc3ccccc3)=O)[nH]cn2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.5875 |
| logD: | 2.5798 |
| logSw: | -2.8242 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 71.434 |
| InChI Key: | VXAZNQWRLPKYIY-UHFFFAOYSA-N |