5-amino-N-[2-(3,4-diethoxyphenyl)ethyl]-1-[2-(4-methoxyanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-N-[2-(3,4-diethoxyphenyl)ethyl]-1-[2-(4-methoxyanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide
5-amino-N-[2-(3,4-diethoxyphenyl)ethyl]-1-[2-(4-methoxyanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | C368-0766 |
| Compound Name: | 5-amino-N-[2-(3,4-diethoxyphenyl)ethyl]-1-[2-(4-methoxyanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 482.54 |
| Molecular Formula: | C24 H30 N6 O5 |
| Smiles: | CCOc1ccc(CCNC(c2c(N)n(CC(Nc3ccc(cc3)OC)=O)nn2)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 1.2042 |
| logD: | 1.2042 |
| logSw: | -2.2887 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 115.565 |
| InChI Key: | YBKCWRKMXWJDJC-UHFFFAOYSA-N |