1-hydroxy-2-[2-(trifluoromethyl)phenyl]-1,4-dihydro-1,2,4-benzotriazin-3(2H)-one
Chemical Structure Depiction of
1-hydroxy-2-[2-(trifluoromethyl)phenyl]-1,4-dihydro-1,2,4-benzotriazin-3(2H)-one
1-hydroxy-2-[2-(trifluoromethyl)phenyl]-1,4-dihydro-1,2,4-benzotriazin-3(2H)-one
Compound characteristics
| Compound ID: | 3214-0022 |
| Compound Name: | 1-hydroxy-2-[2-(trifluoromethyl)phenyl]-1,4-dihydro-1,2,4-benzotriazin-3(2H)-one |
| Molecular Weight: | 309.24 |
| Molecular Formula: | C14 H10 F3 N3 O2 |
| Smiles: | c1ccc(c(c1)C(F)(F)F)N1C(Nc2ccccc2N1O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.011 |
| logD: | 2.8955 |
| logSw: | -3.6772 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.314 |
| InChI Key: | PEOUHZYVKHMIIF-UHFFFAOYSA-N |