4-{[2-(ethylsulfanyl)-5-oxo-1,3-thiazol-4(5H)-ylidene]methyl}-1,2-phenylene diacetate
Chemical Structure Depiction of
4-{[2-(ethylsulfanyl)-5-oxo-1,3-thiazol-4(5H)-ylidene]methyl}-1,2-phenylene diacetate
4-{[2-(ethylsulfanyl)-5-oxo-1,3-thiazol-4(5H)-ylidene]methyl}-1,2-phenylene diacetate
Compound characteristics
| Compound ID: | 5617-0002 |
| Compound Name: | 4-{[2-(ethylsulfanyl)-5-oxo-1,3-thiazol-4(5H)-ylidene]methyl}-1,2-phenylene diacetate |
| Molecular Weight: | 365.42 |
| Molecular Formula: | C16 H15 N O5 S2 |
| Smiles: | CCSC1=NC(=C/c2ccc(c(c2)OC(C)=O)OC(C)=O)\C(=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.3155 |
| logD: | 3.3155 |
| logSw: | -3.6612 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 64.029 |
| InChI Key: | KMHWWFGYUAQSDU-UHFFFAOYSA-N |