4-(5-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid
Chemical Structure Depiction of
4-(5-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid
4-(5-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid
Compound characteristics
| Compound ID: | 1013-0215 |
| Compound Name: | 4-(5-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid |
| Molecular Weight: | 371.43 |
| Molecular Formula: | C18 H13 N O4 S2 |
| Smiles: | C=CCN1C(/C(=C\c2ccc(c3ccc(cc3)C(O)=O)o2)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4543 |
| logD: | 0.7265 |
| logSw: | -4.3878 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.67 |
| InChI Key: | HDWIFHNHYUITFB-UHFFFAOYSA-N |