methyl 4-{[3-(2,3-dimethylphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}benzoate
Chemical Structure Depiction of
methyl 4-{[3-(2,3-dimethylphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}benzoate
methyl 4-{[3-(2,3-dimethylphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}benzoate
Compound characteristics
| Compound ID: | 2159-3404 |
| Compound Name: | methyl 4-{[3-(2,3-dimethylphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}benzoate |
| Molecular Weight: | 383.49 |
| Molecular Formula: | C20 H17 N O3 S2 |
| Smiles: | Cc1cccc(c1C)N1C(/C(=C/c2ccc(cc2)C(=O)OC)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.008 |
| logD: | 5.008 |
| logSw: | -4.6576 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 36.704 |
| InChI Key: | OLDNJBZQZBHBMS-UHFFFAOYSA-N |