methyl (4-{2-[(2-cyanophenyl)sulfanyl]benzamido}phenoxy)acetate
Chemical Structure Depiction of
methyl (4-{2-[(2-cyanophenyl)sulfanyl]benzamido}phenoxy)acetate
methyl (4-{2-[(2-cyanophenyl)sulfanyl]benzamido}phenoxy)acetate
Compound characteristics
| Compound ID: | 8016-3012 |
| Compound Name: | methyl (4-{2-[(2-cyanophenyl)sulfanyl]benzamido}phenoxy)acetate |
| Molecular Weight: | 418.47 |
| Molecular Formula: | C23 H18 N2 O4 S |
| Smiles: | COC(COc1ccc(cc1)NC(c1ccccc1Sc1ccccc1C#N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8743 |
| logD: | 3.8743 |
| logSw: | -4.0744 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.192 |
| InChI Key: | ALGZXRPIRUENRK-UHFFFAOYSA-N |