N-(3-chloro-4-methylphenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine
N-(3-chloro-4-methylphenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine
Compound characteristics
| Compound ID: | 4061-0050 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-7-nitro-2,1,3-benzoxadiazol-4-amine |
| Molecular Weight: | 304.69 |
| Molecular Formula: | C13 H9 Cl N4 O3 |
| Smiles: | Cc1ccc(cc1[Cl])Nc1ccc(c2c1non2)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2418 |
| logD: | 5.2418 |
| logSw: | -5.8065 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.394 |
| InChI Key: | JJJVRQOAQIFJLZ-UHFFFAOYSA-N |