4-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl acetate
Chemical Structure Depiction of
4-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl acetate
4-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl acetate
Compound characteristics
| Compound ID: | 3584-0057 |
| Compound Name: | 4-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl acetate |
| Molecular Weight: | 319.4 |
| Molecular Formula: | C15 H13 N O3 S2 |
| Smiles: | CC(=O)Oc1ccc(\C=C2/C(N(CC=C)C(=S)S2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.7722 |
| logD: | 2.7722 |
| logSw: | -3.111 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 37.443 |
| InChI Key: | SRQOQCOZDMZTJJ-UHFFFAOYSA-N |