ethyl 4-{2-[(1,3-benzoxazol-2-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 4-{2-[(1,3-benzoxazol-2-yl)sulfanyl]acetamido}benzoate
ethyl 4-{2-[(1,3-benzoxazol-2-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | D058-0202 |
| Compound Name: | ethyl 4-{2-[(1,3-benzoxazol-2-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 356.4 |
| Molecular Formula: | C18 H16 N2 O4 S |
| Smiles: | CCOC(c1ccc(cc1)NC(CSc1nc2ccccc2o1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2666 |
| logD: | 4.2665 |
| logSw: | -4.1263 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.533 |
| InChI Key: | ZNPNSUPAXSQOIG-UHFFFAOYSA-N |