diethyl 1-{2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}-1H-1,2,3-triazole-4,5-dicarboxylate
Chemical Structure Depiction of
diethyl 1-{2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}-1H-1,2,3-triazole-4,5-dicarboxylate
diethyl 1-{2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}-1H-1,2,3-triazole-4,5-dicarboxylate
Compound characteristics
| Compound ID: | C337-0089 |
| Compound Name: | diethyl 1-{2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}-1H-1,2,3-triazole-4,5-dicarboxylate |
| Molecular Weight: | 414.34 |
| Molecular Formula: | C17 H17 F3 N4 O5 |
| Smiles: | CCOC(c1c(C(=O)OCC)n(CC(Nc2ccccc2C(F)(F)F)=O)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1031 |
| logD: | 2.1031 |
| logSw: | -3.0174 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.934 |
| InChI Key: | HMEXPRATOVKBCS-UHFFFAOYSA-N |