(4-fluorophenyl)(4-{7-hydroxy-3-[(2-methylphenyl)methyl]-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}piperidin-1-yl)methanone
Chemical Structure Depiction of
(4-fluorophenyl)(4-{7-hydroxy-3-[(2-methylphenyl)methyl]-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}piperidin-1-yl)methanone
(4-fluorophenyl)(4-{7-hydroxy-3-[(2-methylphenyl)methyl]-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}piperidin-1-yl)methanone
Compound characteristics
| Compound ID: | D122-0062 |
| Compound Name: | (4-fluorophenyl)(4-{7-hydroxy-3-[(2-methylphenyl)methyl]-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}piperidin-1-yl)methanone |
| Molecular Weight: | 446.48 |
| Molecular Formula: | C24 H23 F N6 O2 |
| Smiles: | Cc1ccccc1Cn1c2c(c(nc(C3CCN(CC3)C(c3ccc(cc3)F)=O)n2)O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 3.1884 |
| logD: | 2.7343 |
| logSw: | -2.8806 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.202 |
| InChI Key: | DJJPREJGTZIKEE-UHFFFAOYSA-N |