2-chloro-4-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 4-methoxybenzoate
Chemical Structure Depiction of
2-chloro-4-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 4-methoxybenzoate
2-chloro-4-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 4-methoxybenzoate
Compound characteristics
| Compound ID: | 8014-0686 |
| Compound Name: | 2-chloro-4-{[4-oxo-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenyl 4-methoxybenzoate |
| Molecular Weight: | 445.94 |
| Molecular Formula: | C21 H16 Cl N O4 S2 |
| Smiles: | COc1ccc(cc1)C(=O)Oc1ccc(/C=C2/C(N(CC=C)C(=S)S2)=O)cc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.9234 |
| logD: | 4.9234 |
| logSw: | -5.2289 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 44.701 |
| InChI Key: | NEAFYMWJMKNGLR-UHFFFAOYSA-N |