2-[(7-oxo-3,6-diphenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-[(7-oxo-3,6-diphenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
2-[(7-oxo-3,6-diphenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | K286-0020 |
| Compound Name: | 2-[(7-oxo-3,6-diphenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 570.63 |
| Molecular Formula: | C26 H17 F3 N4 O2 S3 |
| Smiles: | C(C(Nc1cccc(c1)C(F)(F)F)=O)SC1=NC2=C(C(N1c1ccccc1)=O)SC(N2c1ccccc1)=S |
| Stereo: | ACHIRAL |
| logP: | 5.7078 |
| logD: | 5.7076 |
| logSw: | -5.9511 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.104 |
| InChI Key: | PGVJEFCUBFZVDS-UHFFFAOYSA-N |