2-{[7-(3-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino}phenol
Chemical Structure Depiction of
2-{[7-(3-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino}phenol
2-{[7-(3-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino}phenol
Compound characteristics
| Compound ID: | 4061-0059 |
| Compound Name: | 2-{[7-(3-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino}phenol |
| Molecular Weight: | 369.38 |
| Molecular Formula: | C18 H19 N5 O4 |
| Smiles: | CC1CCCN(C1)c1cc(c(c2c1non2)[N+]([O-])=O)Nc1ccccc1O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2241 |
| logD: | 5.224 |
| logSw: | -4.9743 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.028 |
| InChI Key: | NMYVIPLKRRMZKR-NSHDSACASA-N |