2-bromo-4-{[2-(ethylsulfanyl)-5-oxo-1,3-thiazol-4(5H)-ylidene]methyl}phenyl acetate
Chemical Structure Depiction of
2-bromo-4-{[2-(ethylsulfanyl)-5-oxo-1,3-thiazol-4(5H)-ylidene]methyl}phenyl acetate
2-bromo-4-{[2-(ethylsulfanyl)-5-oxo-1,3-thiazol-4(5H)-ylidene]methyl}phenyl acetate
Compound characteristics
| Compound ID: | 5617-0080 |
| Compound Name: | 2-bromo-4-{[2-(ethylsulfanyl)-5-oxo-1,3-thiazol-4(5H)-ylidene]methyl}phenyl acetate |
| Molecular Weight: | 386.28 |
| Molecular Formula: | C14 H12 Br N O3 S2 |
| Smiles: | CCSC1=NC(=C/c2ccc(c(c2)[Br])OC(C)=O)\C(=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.7453 |
| logD: | 3.7453 |
| logSw: | -3.997 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 43.192 |
| InChI Key: | FPZMCBXHRNAYGM-UHFFFAOYSA-N |