N-(2,4-dimethylphenyl)-7-(3-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-5-amine
Chemical Structure Depiction of
N-(2,4-dimethylphenyl)-7-(3-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-5-amine
N-(2,4-dimethylphenyl)-7-(3-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-5-amine
Compound characteristics
| Compound ID: | 4061-0019 |
| Compound Name: | N-(2,4-dimethylphenyl)-7-(3-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-5-amine |
| Molecular Weight: | 381.43 |
| Molecular Formula: | C20 H23 N5 O3 |
| Smiles: | CC1CCCN(C1)c1cc(c(c2c1non2)[N+]([O-])=O)Nc1ccc(C)cc1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1748 |
| logD: | 6.1748 |
| logSw: | -5.4822 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.48 |
| InChI Key: | TZLOPUIMLCJIIR-ZDUSSCGKSA-N |