5-(azepan-1-yl)-4-nitro-2,1,3-benzoxadiazole
Chemical Structure Depiction of
5-(azepan-1-yl)-4-nitro-2,1,3-benzoxadiazole
5-(azepan-1-yl)-4-nitro-2,1,3-benzoxadiazole
Compound characteristics
| Compound ID: | 1616-0077 |
| Compound Name: | 5-(azepan-1-yl)-4-nitro-2,1,3-benzoxadiazole |
| Molecular Weight: | 262.27 |
| Molecular Formula: | C12 H14 N4 O3 |
| Smiles: | C1CCCN(CC1)c1ccc2c(c1[N+]([O-])=O)non2 |
| Stereo: | ACHIRAL |
| logP: | 3.7824 |
| logD: | 3.7824 |
| logSw: | -4.1722 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 72.59 |
| InChI Key: | FHAHPNVKGPUQRX-UHFFFAOYSA-N |