2-methoxy-5-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 4-methylbenzoate
Chemical Structure Depiction of
2-methoxy-5-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 4-methylbenzoate
2-methoxy-5-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 4-methylbenzoate
Compound characteristics
| Compound ID: | 8014-0684 |
| Compound Name: | 2-methoxy-5-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 4-methylbenzoate |
| Molecular Weight: | 425.52 |
| Molecular Formula: | C22 H19 N O4 S2 |
| Smiles: | Cc1ccc(cc1)C(=O)Oc1cc(/C=C2/C(N(CC=C)C(=S)S2)=O)ccc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.928 |
| logD: | 4.928 |
| logSw: | -4.713 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 44.787 |
| InChI Key: | JJGUFLUKLYYRHF-UHFFFAOYSA-N |