4-nitro-2-[(5-nitro-2,1,3-benzoxadiazol-4-yl)amino]phenol
Chemical Structure Depiction of
4-nitro-2-[(5-nitro-2,1,3-benzoxadiazol-4-yl)amino]phenol
4-nitro-2-[(5-nitro-2,1,3-benzoxadiazol-4-yl)amino]phenol
Compound characteristics
| Compound ID: | 3660-0364 |
| Compound Name: | 4-nitro-2-[(5-nitro-2,1,3-benzoxadiazol-4-yl)amino]phenol |
| Molecular Weight: | 317.21 |
| Molecular Formula: | C12 H7 N5 O6 |
| Smiles: | c1cc(c(cc1[N+]([O-])=O)Nc1c(ccc2c1non2)[N+]([O-])=O)O |
| Stereo: | ACHIRAL |
| logP: | 3.1681 |
| logD: | 3.1459 |
| logSw: | -3.2602 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 126.157 |
| InChI Key: | IKQCBXKLQVDSGQ-UHFFFAOYSA-N |