1-hydroxy-2-(3,4,5-trimethoxyphenyl)-1,4-dihydro-1,2,4-benzotriazin-3(2H)-one
Chemical Structure Depiction of
1-hydroxy-2-(3,4,5-trimethoxyphenyl)-1,4-dihydro-1,2,4-benzotriazin-3(2H)-one
1-hydroxy-2-(3,4,5-trimethoxyphenyl)-1,4-dihydro-1,2,4-benzotriazin-3(2H)-one
Compound characteristics
| Compound ID: | C710-0047 |
| Compound Name: | 1-hydroxy-2-(3,4,5-trimethoxyphenyl)-1,4-dihydro-1,2,4-benzotriazin-3(2H)-one |
| Molecular Weight: | 331.33 |
| Molecular Formula: | C16 H17 N3 O5 |
| Smiles: | COc1cc(cc(c1OC)OC)N1C(Nc2ccccc2N1O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0058 |
| logD: | 1.8903 |
| logSw: | -2.7993 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.593 |
| InChI Key: | PQEKIBIWLDKKHE-UHFFFAOYSA-N |