ethyl 1-[2-(2,4-dimethylanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[2-(2,4-dimethylanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxylate
ethyl 1-[2-(2,4-dimethylanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | C513-0034 |
| Compound Name: | ethyl 1-[2-(2,4-dimethylanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 302.33 |
| Molecular Formula: | C15 H18 N4 O3 |
| Smiles: | CCOC(c1cn(CC(Nc2ccc(C)cc2C)=O)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9903 |
| logD: | 1.9903 |
| logSw: | -2.4717 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.957 |
| InChI Key: | XLVAHDPVGHPJCH-UHFFFAOYSA-N |