1-hydroxy-2-(2-methyl-5-nitrophenyl)-1,4-dihydro-1,2,4-benzotriazin-3(2H)-one
Chemical Structure Depiction of
1-hydroxy-2-(2-methyl-5-nitrophenyl)-1,4-dihydro-1,2,4-benzotriazin-3(2H)-one
1-hydroxy-2-(2-methyl-5-nitrophenyl)-1,4-dihydro-1,2,4-benzotriazin-3(2H)-one
Compound characteristics
| Compound ID: | 3214-0020 |
| Compound Name: | 1-hydroxy-2-(2-methyl-5-nitrophenyl)-1,4-dihydro-1,2,4-benzotriazin-3(2H)-one |
| Molecular Weight: | 300.27 |
| Molecular Formula: | C14 H12 N4 O4 |
| Smiles: | Cc1ccc(cc1N1C(Nc2ccccc2N1O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.7859 |
| logD: | 2.6704 |
| logSw: | -3.2313 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.696 |
| InChI Key: | IZYAFRDCAMVETJ-UHFFFAOYSA-N |