N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[8-(3-methoxyphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[8-(3-methoxyphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[8-(3-methoxyphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | M446-0452 |
| Compound Name: | N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[8-(3-methoxyphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide |
| Molecular Weight: | 493.83 |
| Molecular Formula: | C21 H15 Cl F3 N5 O4 |
| Smiles: | COc1cccc(c1)OC1C2=NN(CC(Nc3cc(ccc3[Cl])C(F)(F)F)=O)C(N2C=CN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3778 |
| logD: | 3.368 |
| logSw: | -3.9198 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.06 |
| InChI Key: | FDQXTLABLMKPSQ-UHFFFAOYSA-N |