ethyl 1',3-bis[2-nitro-4-(trifluoromethyl)phenyl]-2,3-dihydro-1H,1'H-[2,2'-biimidazole]-1-carboxylate
Chemical Structure Depiction of
ethyl 1',3-bis[2-nitro-4-(trifluoromethyl)phenyl]-2,3-dihydro-1H,1'H-[2,2'-biimidazole]-1-carboxylate
ethyl 1',3-bis[2-nitro-4-(trifluoromethyl)phenyl]-2,3-dihydro-1H,1'H-[2,2'-biimidazole]-1-carboxylate
Compound characteristics
| Compound ID: | 8018-3626 |
| Compound Name: | ethyl 1',3-bis[2-nitro-4-(trifluoromethyl)phenyl]-2,3-dihydro-1H,1'H-[2,2'-biimidazole]-1-carboxylate |
| Molecular Weight: | 586.41 |
| Molecular Formula: | C23 H16 F6 N6 O6 |
| Smiles: | CCOC(N1C=CN(C1c1nccn1c1ccc(cc1[N+]([O-])=O)C(F)(F)F)c1ccc(cc1[N+]([O-])=O)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3407 |
| logD: | 4.3407 |
| logSw: | -4.4722 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 101.426 |
| InChI Key: | CCPUPIGBQAXHQQ-HXUWFJFHSA-N |