ethyl 4-(2-{[1-(2-methylphenyl)-1H-imidazol-2-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 4-(2-{[1-(2-methylphenyl)-1H-imidazol-2-yl]sulfanyl}acetamido)benzoate
ethyl 4-(2-{[1-(2-methylphenyl)-1H-imidazol-2-yl]sulfanyl}acetamido)benzoate
Compound characteristics
| Compound ID: | G856-1979 |
| Compound Name: | ethyl 4-(2-{[1-(2-methylphenyl)-1H-imidazol-2-yl]sulfanyl}acetamido)benzoate |
| Molecular Weight: | 395.48 |
| Molecular Formula: | C21 H21 N3 O3 S |
| Smiles: | [H]N(C(CSc1nccn1c1ccccc1C)=O)c1ccc(cc1)C(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 4.3652 |
| logD: | 4.3509 |
| logSw: | -4.1633 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.12 |
| InChI Key: | MHHPIEFYZNSBKG-UHFFFAOYSA-N |