ethyl 1-{4-[(2-ethoxy-2-oxoethyl)amino]-6-(morpholin-4-yl)-1,3,5-triazin-2-yl}-5-phenyl-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{4-[(2-ethoxy-2-oxoethyl)amino]-6-(morpholin-4-yl)-1,3,5-triazin-2-yl}-5-phenyl-1H-1,2,3-triazole-4-carboxylate
ethyl 1-{4-[(2-ethoxy-2-oxoethyl)amino]-6-(morpholin-4-yl)-1,3,5-triazin-2-yl}-5-phenyl-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | 8013-6245 |
| Compound Name: | ethyl 1-{4-[(2-ethoxy-2-oxoethyl)amino]-6-(morpholin-4-yl)-1,3,5-triazin-2-yl}-5-phenyl-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 482.5 |
| Molecular Formula: | C22 H26 N8 O5 |
| Smiles: | CCOC(CNc1nc(nc(n1)n1c(c2ccccc2)c(C(=O)OCC)nn1)N1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0983 |
| logD: | 3.0982 |
| logSw: | -3.0466 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 117.473 |
| InChI Key: | CNBMDVXYQGYOHT-UHFFFAOYSA-N |