ethyl ({6-[2-(2-methylphenoxy)acetamido]-1,3-benzothiazol-2-yl}sulfanyl)acetate
Chemical Structure Depiction of
ethyl ({6-[2-(2-methylphenoxy)acetamido]-1,3-benzothiazol-2-yl}sulfanyl)acetate
ethyl ({6-[2-(2-methylphenoxy)acetamido]-1,3-benzothiazol-2-yl}sulfanyl)acetate
Compound characteristics
| Compound ID: | D336-5991 |
| Compound Name: | ethyl ({6-[2-(2-methylphenoxy)acetamido]-1,3-benzothiazol-2-yl}sulfanyl)acetate |
| Molecular Weight: | 416.52 |
| Molecular Formula: | C20 H20 N2 O4 S2 |
| Smiles: | CCOC(CSc1nc2ccc(cc2s1)NC(COc1ccccc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8597 |
| logD: | 4.8597 |
| logSw: | -4.6103 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.942 |
| InChI Key: | QLJKVLMVXDYDBU-UHFFFAOYSA-N |