ethyl 1-[4-ethoxy-6-(piperidin-1-yl)-1,3,5-triazin-2-yl]-5-methyl-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[4-ethoxy-6-(piperidin-1-yl)-1,3,5-triazin-2-yl]-5-methyl-1H-1,2,3-triazole-4-carboxylate
ethyl 1-[4-ethoxy-6-(piperidin-1-yl)-1,3,5-triazin-2-yl]-5-methyl-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | 8012-8537 |
| Compound Name: | ethyl 1-[4-ethoxy-6-(piperidin-1-yl)-1,3,5-triazin-2-yl]-5-methyl-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 361.4 |
| Molecular Formula: | C16 H23 N7 O3 |
| Smiles: | CCOC(c1c(C)n(c2nc(nc(n2)OCC)N2CCCCC2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2384 |
| logD: | 3.2384 |
| logSw: | -2.9892 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 85.932 |
| InChI Key: | VMBRWGYRDAOMHU-UHFFFAOYSA-N |