4-{[3-(3-chlorophenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2-methoxyphenyl 4-fluorobenzoate
Chemical Structure Depiction of
4-{[3-(3-chlorophenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2-methoxyphenyl 4-fluorobenzoate
4-{[3-(3-chlorophenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2-methoxyphenyl 4-fluorobenzoate
Compound characteristics
| Compound ID: | 3358-3555 |
| Compound Name: | 4-{[3-(3-chlorophenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2-methoxyphenyl 4-fluorobenzoate |
| Molecular Weight: | 499.97 |
| Molecular Formula: | C24 H15 Cl F N O4 S2 |
| Smiles: | COc1cc(\C=C2/C(N(C(=S)S2)c2cccc(c2)[Cl])=O)ccc1OC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6753 |
| logD: | 5.6753 |
| logSw: | -6.2118 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 43.926 |
| InChI Key: | QUHCVLWMEBBIOX-UHFFFAOYSA-N |