2-{8-[(3-fluorophenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-[3-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-{8-[(3-fluorophenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-[3-(trifluoromethyl)phenyl]acetamide
2-{8-[(3-fluorophenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-[3-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | M451-2280 |
| Compound Name: | 2-{8-[(3-fluorophenyl)sulfanyl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-[3-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 463.41 |
| Molecular Formula: | C20 H13 F4 N5 O2 S |
| Smiles: | C(C(Nc1cccc(c1)C(F)(F)F)=O)N1C(N2C=CN=C(C2=N1)Sc1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7473 |
| logD: | 3.7472 |
| logSw: | -4.1034 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.586 |
| InChI Key: | MAIUTSNYCQDPKX-UHFFFAOYSA-N |