7-chloro-N-(4-methoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine
Chemical Structure Depiction of
7-chloro-N-(4-methoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine
7-chloro-N-(4-methoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine
Compound characteristics
| Compound ID: | R073-0019 |
| Compound Name: | 7-chloro-N-(4-methoxyphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine |
| Molecular Weight: | 320.69 |
| Molecular Formula: | C13 H9 Cl N4 O4 |
| Smiles: | COc1ccc(cc1)Nc1cc(c2c(c1[N+]([O-])=O)non2)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.6599 |
| logD: | 4.6599 |
| logSw: | -4.9962 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.637 |
| InChI Key: | CLUXLTSHVTWONO-UHFFFAOYSA-N |