3-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methylbenzoate
Chemical Structure Depiction of
3-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methylbenzoate
3-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methylbenzoate
Compound characteristics
| Compound ID: | 3681-1255 |
| Compound Name: | 3-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methylbenzoate |
| Molecular Weight: | 355.43 |
| Molecular Formula: | C18 H13 N O3 S2 |
| Smiles: | Cc1ccc(cc1)C(=O)Oc1cccc(/C=C2/C(NC(=S)S2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.0785 |
| logD: | 1.7273 |
| logSw: | -3.4157 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.278 |
| InChI Key: | NZKIYNIDJLYIDZ-UHFFFAOYSA-N |