1-methyl-5-[5-(3-nitrophenyl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazole
Chemical Structure Depiction of
1-methyl-5-[5-(3-nitrophenyl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazole
1-methyl-5-[5-(3-nitrophenyl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazole
Compound characteristics
| Compound ID: | G944-0120 |
| Compound Name: | 1-methyl-5-[5-(3-nitrophenyl)-1,2,4-oxadiazol-3-yl]-1H-benzotriazole |
| Molecular Weight: | 322.28 |
| Molecular Formula: | C15 H10 N6 O3 |
| Smiles: | Cn1c2ccc(cc2nn1)c1nc(c2cccc(c2)[N+]([O-])=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.0288 |
| logD: | 3.0288 |
| logSw: | -3.2942 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 91.009 |
| InChI Key: | WRUNRCSXASMOOQ-UHFFFAOYSA-N |