methyl {2-[(1,3-benzothiazol-2-yl)sulfanyl]acetamido}(phenyl)acetate
Chemical Structure Depiction of
methyl {2-[(1,3-benzothiazol-2-yl)sulfanyl]acetamido}(phenyl)acetate
methyl {2-[(1,3-benzothiazol-2-yl)sulfanyl]acetamido}(phenyl)acetate
Compound characteristics
| Compound ID: | 8016-0808 |
| Compound Name: | methyl {2-[(1,3-benzothiazol-2-yl)sulfanyl]acetamido}(phenyl)acetate |
| Molecular Weight: | 372.46 |
| Molecular Formula: | C18 H16 N2 O3 S2 |
| Smiles: | COC(C(c1ccccc1)NC(CSc1nc2ccccc2s1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3607 |
| logD: | 3.3607 |
| logSw: | -3.6304 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.046 |
| InChI Key: | DAJMXYVFPCVBFW-MRXNPFEDSA-N |