diethyl 1-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-1H-1,2,3-triazole-4,5-dicarboxylate
					Chemical Structure Depiction of
diethyl 1-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-1H-1,2,3-triazole-4,5-dicarboxylate
			diethyl 1-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-1H-1,2,3-triazole-4,5-dicarboxylate
Compound characteristics
| Compound ID: | C200-4669 | 
| Compound Name: | diethyl 1-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-1H-1,2,3-triazole-4,5-dicarboxylate | 
| Molecular Weight: | 443.23 | 
| Molecular Formula: | C16 H16 Br F N4 O5 | 
| Smiles: | CCOC(c1c(C(=O)OCC)n(CC(Nc2ccc(cc2F)[Br])=O)nn1)=O | 
| Stereo: | ACHIRAL | 
| logP: | 2.268 | 
| logD: | 2.2617 | 
| logSw: | -2.9735 | 
| Hydrogen bond acceptors count: | 10 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 89.934 | 
| InChI Key: | ITNCJPCOPRIEDN-UHFFFAOYSA-N | 
 
				 
				