N-[(5-nitro-1H-benzotriazol-1-yl)methyl]-4-phenyl-1,2,5-oxadiazol-3-amine
Chemical Structure Depiction of
N-[(5-nitro-1H-benzotriazol-1-yl)methyl]-4-phenyl-1,2,5-oxadiazol-3-amine
N-[(5-nitro-1H-benzotriazol-1-yl)methyl]-4-phenyl-1,2,5-oxadiazol-3-amine
Compound characteristics
| Compound ID: | 8011-6181 |
| Compound Name: | N-[(5-nitro-1H-benzotriazol-1-yl)methyl]-4-phenyl-1,2,5-oxadiazol-3-amine |
| Molecular Weight: | 337.3 |
| Molecular Formula: | C15 H11 N7 O3 |
| Smiles: | C(Nc1c(c2ccccc2)non1)n1c2ccc(cc2nn1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.065 |
| logD: | 3.065 |
| logSw: | -3.4303 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 106.962 |
| InChI Key: | MLVOEATVFJVCRH-UHFFFAOYSA-N |