diethyl 1-{2-[(2-fluorophenyl)carbamamido]-2-oxoethyl}-1H-1,2,3-triazole-4,5-dicarboxylate
Chemical Structure Depiction of
diethyl 1-{2-[(2-fluorophenyl)carbamamido]-2-oxoethyl}-1H-1,2,3-triazole-4,5-dicarboxylate
diethyl 1-{2-[(2-fluorophenyl)carbamamido]-2-oxoethyl}-1H-1,2,3-triazole-4,5-dicarboxylate
Compound characteristics
| Compound ID: | C200-1948 |
| Compound Name: | diethyl 1-{2-[(2-fluorophenyl)carbamamido]-2-oxoethyl}-1H-1,2,3-triazole-4,5-dicarboxylate |
| Molecular Weight: | 407.36 |
| Molecular Formula: | C17 H18 F N5 O6 |
| Smiles: | CCOC(c1c(C(=O)OCC)n(CC(NC(Nc2ccccc2F)=O)=O)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2668 |
| logD: | 1.2422 |
| logSw: | -2.2135 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 113.324 |
| InChI Key: | VXFJZRZWCYOGJU-UHFFFAOYSA-N |