ethyl 2-{2-[(1,3-benzoxazol-2-yl)sulfanyl]acetamido}-1,3-benzothiazole-6-carboxylate
Chemical Structure Depiction of
ethyl 2-{2-[(1,3-benzoxazol-2-yl)sulfanyl]acetamido}-1,3-benzothiazole-6-carboxylate
ethyl 2-{2-[(1,3-benzoxazol-2-yl)sulfanyl]acetamido}-1,3-benzothiazole-6-carboxylate
Compound characteristics
| Compound ID: | 8008-0604 |
| Compound Name: | ethyl 2-{2-[(1,3-benzoxazol-2-yl)sulfanyl]acetamido}-1,3-benzothiazole-6-carboxylate |
| Molecular Weight: | 413.47 |
| Molecular Formula: | C19 H15 N3 O4 S2 |
| Smiles: | CCOC(c1ccc2c(c1)sc(NC(CSc1nc3ccccc3o1)=O)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0311 |
| logD: | 5.031 |
| logSw: | -4.661 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.295 |
| InChI Key: | HCFLQXIHBCMLHY-UHFFFAOYSA-N |