4-nitro-7-(pyrrolidin-1-yl)-2,1,3-benzoxadiazole
Chemical Structure Depiction of
4-nitro-7-(pyrrolidin-1-yl)-2,1,3-benzoxadiazole
4-nitro-7-(pyrrolidin-1-yl)-2,1,3-benzoxadiazole
Compound characteristics
| Compound ID: | 3660-0314 |
| Compound Name: | 4-nitro-7-(pyrrolidin-1-yl)-2,1,3-benzoxadiazole |
| Molecular Weight: | 234.21 |
| Molecular Formula: | C10 H10 N4 O3 |
| Smiles: | C1CCN(C1)c1ccc(c2c1non2)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.475 |
| logD: | 2.475 |
| logSw: | -2.5144 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 73.697 |
| InChI Key: | KVFXCHFZIJJFCA-UHFFFAOYSA-N |