(3-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetic acid
Chemical Structure Depiction of
(3-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetic acid
(3-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetic acid
Compound characteristics
| Compound ID: | 3229-0237 |
| Compound Name: | (3-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetic acid |
| Molecular Weight: | 335.4 |
| Molecular Formula: | C15 H13 N O4 S2 |
| Smiles: | C=CCN1C(/C(=C\c2cccc(c2)OCC(O)=O)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5573 |
| logD: | -1.6797 |
| logSw: | -2.6388 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.575 |
| InChI Key: | HBEQAAFPIZBXET-UHFFFAOYSA-N |