2-[3-oxo-8-(phenylsulfanyl)[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-[3-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-[3-oxo-8-(phenylsulfanyl)[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-[3-(trifluoromethyl)phenyl]acetamide
2-[3-oxo-8-(phenylsulfanyl)[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-[3-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | M451-0309 |
| Compound Name: | 2-[3-oxo-8-(phenylsulfanyl)[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-[3-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 445.42 |
| Molecular Formula: | C20 H14 F3 N5 O2 S |
| Smiles: | C(C(Nc1cccc(c1)C(F)(F)F)=O)N1C(N2C=CN=C(C2=N1)Sc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6434 |
| logD: | 3.6433 |
| logSw: | -4.0402 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.586 |
| InChI Key: | GSWNHLWAAPXNJH-UHFFFAOYSA-N |