benzyl (5-oxo-3-phenyl-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]thieno[2,3-e]pyrimidin-4(5H)-yl)acetate
Chemical Structure Depiction of
benzyl (5-oxo-3-phenyl-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]thieno[2,3-e]pyrimidin-4(5H)-yl)acetate
benzyl (5-oxo-3-phenyl-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]thieno[2,3-e]pyrimidin-4(5H)-yl)acetate
Compound characteristics
| Compound ID: | C870-0149 |
| Compound Name: | benzyl (5-oxo-3-phenyl-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]thieno[2,3-e]pyrimidin-4(5H)-yl)acetate |
| Molecular Weight: | 464.58 |
| Molecular Formula: | C23 H16 N2 O3 S3 |
| Smiles: | C(C(=O)OCc1ccccc1)N1C2=C(c3ccccc3)SC(N2c2ccsc2C1=O)=S |
| Stereo: | ACHIRAL |
| logP: | 5.2278 |
| logD: | 5.2278 |
| logSw: | -5.3993 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 39.341 |
| InChI Key: | NVGQTFUAXWQYIG-UHFFFAOYSA-N |