5-[(3-fluoroanilino)methyl]-2-[(2-fluorophenyl)methyl]-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
5-[(3-fluoroanilino)methyl]-2-[(2-fluorophenyl)methyl]-2,4-dihydro-3H-1,2,4-triazol-3-one
5-[(3-fluoroanilino)methyl]-2-[(2-fluorophenyl)methyl]-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | 8020-4643 |
| Compound Name: | 5-[(3-fluoroanilino)methyl]-2-[(2-fluorophenyl)methyl]-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 316.31 |
| Molecular Formula: | C16 H14 F2 N4 O |
| Smiles: | C(C1NC(N(Cc2ccccc2F)N=1)=O)Nc1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 3.3193 |
| logD: | 3.3119 |
| logSw: | -3.4751 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.641 |
| InChI Key: | QFPNPMXMTHWCAJ-UHFFFAOYSA-N |