diethyl 4,4'-{[1,1,1,4,4,4-hexafluoro-2,3-bis(trifluoromethyl)butane-2,3-diyl]bis(oxycarbonylazanediyl)}dibenzoate
Chemical Structure Depiction of
diethyl 4,4'-{[1,1,1,4,4,4-hexafluoro-2,3-bis(trifluoromethyl)butane-2,3-diyl]bis(oxycarbonylazanediyl)}dibenzoate
diethyl 4,4'-{[1,1,1,4,4,4-hexafluoro-2,3-bis(trifluoromethyl)butane-2,3-diyl]bis(oxycarbonylazanediyl)}dibenzoate
Compound characteristics
| Compound ID: | 8003-1237 |
| Compound Name: | diethyl 4,4'-{[1,1,1,4,4,4-hexafluoro-2,3-bis(trifluoromethyl)butane-2,3-diyl]bis(oxycarbonylazanediyl)}dibenzoate |
| Molecular Weight: | 716.43 |
| Molecular Formula: | C26 H20 F12 N2 O8 |
| Smiles: | CCOC(c1ccc(cc1)NC(=O)OC(C(C(F)(F)F)(C(F)(F)F)OC(Nc1ccc(cc1)C(=O)OCC)=O)(C(F)(F)F)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 8.1538 |
| logD: | 8.1538 |
| logSw: | -5.9188 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.499 |
| InChI Key: | NPKPETAYPDWJMJ-UHFFFAOYSA-N |