2-{[4-(2H-1,3-benzodioxol-5-yl)-1-phenyl-1H-imidazol-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Chemical Structure Depiction of
2-{[4-(2H-1,3-benzodioxol-5-yl)-1-phenyl-1H-imidazol-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide
2-{[4-(2H-1,3-benzodioxol-5-yl)-1-phenyl-1H-imidazol-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Compound characteristics
Compound ID: | K242-1015 |
Compound Name: | 2-{[4-(2H-1,3-benzodioxol-5-yl)-1-phenyl-1H-imidazol-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide |
Molecular Weight: | 443.52 |
Molecular Formula: | C25 H21 N3 O3 S |
Smiles: | Cc1cccc(c1)NC(CSc1nc(cn1c1ccccc1)c1ccc2c(c1)OCO2)=O |
Stereo: | ACHIRAL |
logP: | 5.7467 |
logD: | 5.746 |
logSw: | -5.3431 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.972 |
InChI Key: | STFXTTGUQAEAJA-UHFFFAOYSA-N |