ethyl 2-(2-{[1-benzyl-5-(hydroxymethyl)-1H-imidazol-2-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 2-(2-{[1-benzyl-5-(hydroxymethyl)-1H-imidazol-2-yl]sulfanyl}acetamido)benzoate
ethyl 2-(2-{[1-benzyl-5-(hydroxymethyl)-1H-imidazol-2-yl]sulfanyl}acetamido)benzoate
Compound characteristics
| Compound ID: | G621-0176 |
| Compound Name: | ethyl 2-(2-{[1-benzyl-5-(hydroxymethyl)-1H-imidazol-2-yl]sulfanyl}acetamido)benzoate |
| Molecular Weight: | 425.51 |
| Molecular Formula: | C22 H23 N3 O4 S |
| Smiles: | CCOC(c1ccccc1NC(CSc1ncc(CO)n1Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3003 |
| logD: | 3.2873 |
| logSw: | -3.4131 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.564 |
| InChI Key: | MICVSRCKUZNNLG-UHFFFAOYSA-N |