2-[3-(3,4-diethoxyphenyl)-1,2-oxazol-5-yl]-1-hydroxy-1,4-dihydro-1,2,4-benzotriazin-3(2H)-one
Chemical Structure Depiction of
2-[3-(3,4-diethoxyphenyl)-1,2-oxazol-5-yl]-1-hydroxy-1,4-dihydro-1,2,4-benzotriazin-3(2H)-one
2-[3-(3,4-diethoxyphenyl)-1,2-oxazol-5-yl]-1-hydroxy-1,4-dihydro-1,2,4-benzotriazin-3(2H)-one
Compound characteristics
| Compound ID: | C710-0125 |
| Compound Name: | 2-[3-(3,4-diethoxyphenyl)-1,2-oxazol-5-yl]-1-hydroxy-1,4-dihydro-1,2,4-benzotriazin-3(2H)-one |
| Molecular Weight: | 396.4 |
| Molecular Formula: | C20 H20 N4 O5 |
| Smiles: | CCOc1ccc(cc1OCC)c1cc(N2C(Nc3ccccc3N2O)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.087 |
| logD: | 3.032 |
| logSw: | -3.4272 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.178 |
| InChI Key: | TYLCBGDPQZQOIH-UHFFFAOYSA-N |