diethyl 1-{2-[4-(methoxycarbonyl)anilino]-2-oxoethyl}-1H-1,2,3-triazole-4,5-dicarboxylate
Chemical Structure Depiction of
diethyl 1-{2-[4-(methoxycarbonyl)anilino]-2-oxoethyl}-1H-1,2,3-triazole-4,5-dicarboxylate
diethyl 1-{2-[4-(methoxycarbonyl)anilino]-2-oxoethyl}-1H-1,2,3-triazole-4,5-dicarboxylate
Compound characteristics
| Compound ID: | C200-4670 |
| Compound Name: | diethyl 1-{2-[4-(methoxycarbonyl)anilino]-2-oxoethyl}-1H-1,2,3-triazole-4,5-dicarboxylate |
| Molecular Weight: | 404.38 |
| Molecular Formula: | C18 H20 N4 O7 |
| Smiles: | CCOC(c1c(C(=O)OCC)n(CC(Nc2ccc(cc2)C(=O)OC)=O)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6782 |
| logD: | 1.6782 |
| logSw: | -2.3397 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 111.805 |
| InChI Key: | VMPUWXFYUVIIKW-UHFFFAOYSA-N |