(5-{[4-(acetyloxy)-3,5-dimethoxyphenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)acetic acid
Chemical Structure Depiction of
(5-{[4-(acetyloxy)-3,5-dimethoxyphenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)acetic acid
(5-{[4-(acetyloxy)-3,5-dimethoxyphenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)acetic acid
Compound characteristics
| Compound ID: | 8010-0864 |
| Compound Name: | (5-{[4-(acetyloxy)-3,5-dimethoxyphenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)acetic acid |
| Molecular Weight: | 397.42 |
| Molecular Formula: | C16 H15 N O7 S2 |
| Smiles: | CC(=O)Oc1c(cc(\C=C2/C(N(CC(O)=O)C(=S)S2)=O)cc1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 0.6994 |
| logD: | -2.4195 |
| logSw: | -1.5378 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.283 |
| InChI Key: | MJVCIHUULNCOMB-UHFFFAOYSA-N |