N~2~-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N~1~-(5-nitroquinolin-8-yl)propane-1,2-diamine
Chemical Structure Depiction of
N~2~-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N~1~-(5-nitroquinolin-8-yl)propane-1,2-diamine
N~2~-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N~1~-(5-nitroquinolin-8-yl)propane-1,2-diamine
Compound characteristics
| Compound ID: | 8010-4819 |
| Compound Name: | N~2~-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N~1~-(5-nitroquinolin-8-yl)propane-1,2-diamine |
| Molecular Weight: | 480.36 |
| Molecular Formula: | C19 H15 F3 N6 O6 |
| Smiles: | CC(CNc1ccc(c2cccnc12)[N+]([O-])=O)Nc1c(cc(cc1[N+]([O-])=O)C(F)(F)F)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2678 |
| logD: | 4.2678 |
| logSw: | -4.4219 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 127.102 |
| InChI Key: | ADWIPVJBIDKVKS-JTQLQIEISA-N |