3-{4-(4-methoxyphenyl)-2-[2-(phenylsulfanyl)acetamido]-1,3-thiazol-5-yl}propanoic acid
Chemical Structure Depiction of
3-{4-(4-methoxyphenyl)-2-[2-(phenylsulfanyl)acetamido]-1,3-thiazol-5-yl}propanoic acid
3-{4-(4-methoxyphenyl)-2-[2-(phenylsulfanyl)acetamido]-1,3-thiazol-5-yl}propanoic acid
Compound characteristics
| Compound ID: | D041-0043 |
| Compound Name: | 3-{4-(4-methoxyphenyl)-2-[2-(phenylsulfanyl)acetamido]-1,3-thiazol-5-yl}propanoic acid |
| Molecular Weight: | 428.53 |
| Molecular Formula: | C21 H20 N2 O4 S2 |
| Smiles: | COc1ccc(cc1)c1c(CCC(O)=O)sc(NC(CSc2ccccc2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.1689 |
| logD: | 1.3422 |
| logSw: | -4.1287 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.589 |
| InChI Key: | GFDKNYCEZBCNLK-UHFFFAOYSA-N |