butyl 4-{2-[(2-anilino-2-oxoethyl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
butyl 4-{2-[(2-anilino-2-oxoethyl)sulfanyl]acetamido}benzoate
butyl 4-{2-[(2-anilino-2-oxoethyl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | 8012-5149 |
| Compound Name: | butyl 4-{2-[(2-anilino-2-oxoethyl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 400.5 |
| Molecular Formula: | C21 H24 N2 O4 S |
| Smiles: | CCCCOC(c1ccc(cc1)NC(CSCC(Nc1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6207 |
| logD: | 4.6206 |
| logSw: | -4.3963 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.313 |
| InChI Key: | HVTXTIHYIVCDIR-UHFFFAOYSA-N |