N~1~-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N~3~-(5-nitroquinolin-8-yl)propane-1,3-diamine
Chemical Structure Depiction of
N~1~-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N~3~-(5-nitroquinolin-8-yl)propane-1,3-diamine
N~1~-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N~3~-(5-nitroquinolin-8-yl)propane-1,3-diamine
Compound characteristics
| Compound ID: | 8010-6947 |
| Compound Name: | N~1~-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N~3~-(5-nitroquinolin-8-yl)propane-1,3-diamine |
| Molecular Weight: | 480.36 |
| Molecular Formula: | C19 H15 F3 N6 O6 |
| Smiles: | C(CNc1ccc(c2cccnc12)[N+]([O-])=O)CNc1c(cc(cc1[N+]([O-])=O)C(F)(F)F)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.8705 |
| logD: | 3.8705 |
| logSw: | -4.2917 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 127.344 |
| InChI Key: | LKTROXDHPNVMHN-UHFFFAOYSA-N |