3-(5-{[4-(methoxycarbonyl)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid
Chemical Structure Depiction of
3-(5-{[4-(methoxycarbonyl)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid
3-(5-{[4-(methoxycarbonyl)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid
Compound characteristics
| Compound ID: | 2389-2672 |
| Compound Name: | 3-(5-{[4-(methoxycarbonyl)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid |
| Molecular Weight: | 351.4 |
| Molecular Formula: | C15 H13 N O5 S2 |
| Smiles: | COC(c1ccc(/C=C2/C(N(CCC(O)=O)C(=S)S2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7504 |
| logD: | -0.7822 |
| logSw: | -2.1565 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.25 |
| InChI Key: | AWSDWAJDVYFTCG-UHFFFAOYSA-N |