4-{[3-(1-ethyl-1H-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-{[3-(1-ethyl-1H-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}-2H-1,4-benzoxazin-3(4H)-one
4-{[3-(1-ethyl-1H-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | G944-0299 |
| Compound Name: | 4-{[3-(1-ethyl-1H-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 376.37 |
| Molecular Formula: | C19 H16 N6 O3 |
| Smiles: | CCn1c2ccc(cc2nn1)c1nc(CN2C(COc3ccccc23)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.3565 |
| logD: | 2.3565 |
| logSw: | -2.8365 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 80.834 |
| InChI Key: | AJTMGEWNTJCJNY-UHFFFAOYSA-N |