2-[(3,5-difluorophenyl)methyl]-7-(4-fluoroanilino)-5-methyl[1,2,4]triazolo[4,3-a]pyrimidin-3(2H)-one
Chemical Structure Depiction of
2-[(3,5-difluorophenyl)methyl]-7-(4-fluoroanilino)-5-methyl[1,2,4]triazolo[4,3-a]pyrimidin-3(2H)-one
2-[(3,5-difluorophenyl)methyl]-7-(4-fluoroanilino)-5-methyl[1,2,4]triazolo[4,3-a]pyrimidin-3(2H)-one
Compound characteristics
| Compound ID: | P573-7634 |
| Compound Name: | 2-[(3,5-difluorophenyl)methyl]-7-(4-fluoroanilino)-5-methyl[1,2,4]triazolo[4,3-a]pyrimidin-3(2H)-one |
| Molecular Weight: | 385.35 |
| Molecular Formula: | C19 H14 F3 N5 O |
| Smiles: | CC1=CC(Nc2ccc(cc2)F)=NC2=NN(Cc3cc(cc(c3)F)F)C(N12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8605 |
| logD: | 3.8588 |
| logSw: | -3.9467 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.51 |
| InChI Key: | DPFFFFNEJNDFPV-UHFFFAOYSA-N |