N-[(5-oxo-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]-2-[3-(trifluoromethyl)phenoxy]acetamide
Chemical Structure Depiction of
N-[(5-oxo-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]-2-[3-(trifluoromethyl)phenoxy]acetamide
N-[(5-oxo-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]-2-[3-(trifluoromethyl)phenoxy]acetamide
Compound characteristics
| Compound ID: | F527-0047 |
| Compound Name: | N-[(5-oxo-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]-2-[3-(trifluoromethyl)phenoxy]acetamide |
| Molecular Weight: | 460.43 |
| Molecular Formula: | C21 H15 F3 N4 O3 S |
| Smiles: | C(C1=CC(N2C(=N1)SC(c1ccccc1)=N2)=O)NC(COc1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4099 |
| logD: | 3.409 |
| logSw: | -3.9261 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.97 |
| InChI Key: | BBSWASXMSUWCHJ-UHFFFAOYSA-N |