4-{[3-(3-fluorophenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2-methoxyphenyl thiophene-2-carboxylate
Chemical Structure Depiction of
4-{[3-(3-fluorophenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2-methoxyphenyl thiophene-2-carboxylate
4-{[3-(3-fluorophenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2-methoxyphenyl thiophene-2-carboxylate
Compound characteristics
| Compound ID: | 3229-1708 |
| Compound Name: | 4-{[3-(3-fluorophenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2-methoxyphenyl thiophene-2-carboxylate |
| Molecular Weight: | 471.55 |
| Molecular Formula: | C22 H14 F N O4 S3 |
| Smiles: | COc1cc(\C=C2/C(N(C(=S)S2)c2cccc(c2)F)=O)ccc1OC(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.034 |
| logD: | 5.034 |
| logSw: | -4.9505 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 44.944 |
| InChI Key: | QCYKBKRUYZCXAQ-UHFFFAOYSA-N |