4-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-chlorobenzoate
Chemical Structure Depiction of
4-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-chlorobenzoate
4-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-chlorobenzoate
Compound characteristics
| Compound ID: | 1588-0358 |
| Compound Name: | 4-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-chlorobenzoate |
| Molecular Weight: | 389.88 |
| Molecular Formula: | C18 H12 Cl N O3 S2 |
| Smiles: | CN1C(/C(=C\c2ccc(cc2)OC(c2ccc(cc2)[Cl])=O)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1676 |
| logD: | 4.1676 |
| logSw: | -4.8698 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 36.857 |
| InChI Key: | QAAASDAACJMRHA-UHFFFAOYSA-N |