(4-{3-[(4-ethoxyphenyl)methyl]-7-hydroxy-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}piperidin-1-yl)(phenyl)methanone
Chemical Structure Depiction of
(4-{3-[(4-ethoxyphenyl)methyl]-7-hydroxy-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}piperidin-1-yl)(phenyl)methanone
(4-{3-[(4-ethoxyphenyl)methyl]-7-hydroxy-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}piperidin-1-yl)(phenyl)methanone
Compound characteristics
| Compound ID: | D122-0068 |
| Compound Name: | (4-{3-[(4-ethoxyphenyl)methyl]-7-hydroxy-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}piperidin-1-yl)(phenyl)methanone |
| Molecular Weight: | 458.52 |
| Molecular Formula: | C25 H26 N6 O3 |
| Smiles: | CCOc1ccc(Cn2c3c(c(nc(C4CCN(CC4)C(c4ccccc4)=O)n3)O)nn2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.6322 |
| logD: | 2.1782 |
| logSw: | -2.6274 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.326 |
| InChI Key: | OKMHZUZUKUKPRT-UHFFFAOYSA-N |