5,7-dinitro-N-(prop-2-en-1-yl)-2,1,3-benzoxadiazol-4-amine
Chemical Structure Depiction of
5,7-dinitro-N-(prop-2-en-1-yl)-2,1,3-benzoxadiazol-4-amine
5,7-dinitro-N-(prop-2-en-1-yl)-2,1,3-benzoxadiazol-4-amine
Compound characteristics
| Compound ID: | 3660-0342 |
| Compound Name: | 5,7-dinitro-N-(prop-2-en-1-yl)-2,1,3-benzoxadiazol-4-amine |
| Molecular Weight: | 265.18 |
| Molecular Formula: | C9 H7 N5 O5 |
| Smiles: | C=CCNc1c(cc(c2c1non2)[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.852 |
| logD: | 1.852 |
| logSw: | -2.2313 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 112.212 |
| InChI Key: | LITNVHYIBKOKHS-UHFFFAOYSA-N |