5-[(2-oxo-2-phenylethyl)sulfanyl]-6-phenyl-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
5-[(2-oxo-2-phenylethyl)sulfanyl]-6-phenyl-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
5-[(2-oxo-2-phenylethyl)sulfanyl]-6-phenyl-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | A0018511 |
| Compound Name: | 5-[(2-oxo-2-phenylethyl)sulfanyl]-6-phenyl-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 555.62 |
| Molecular Formula: | C26 H16 F3 N3 O2 S3 |
| Smiles: | C(C(c1ccccc1)=O)SC1=NC2=C(C(N1c1ccccc1)=O)SC(N2c1cccc(c1)C(F)(F)F)=S |
| Stereo: | ACHIRAL |
| logP: | 5.6648 |
| logD: | 5.6648 |
| logSw: | -5.971 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 40.201 |
| InChI Key: | IMDNQNNTDIVUSR-UHFFFAOYSA-N |