2-cyclopentyl-1-(4-{3-[(2-fluorophenyl)methyl]-7-hydroxy-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}piperidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-cyclopentyl-1-(4-{3-[(2-fluorophenyl)methyl]-7-hydroxy-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}piperidin-1-yl)ethan-1-one
2-cyclopentyl-1-(4-{3-[(2-fluorophenyl)methyl]-7-hydroxy-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}piperidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | D203-0110 |
| Compound Name: | 2-cyclopentyl-1-(4-{3-[(2-fluorophenyl)methyl]-7-hydroxy-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}piperidin-1-yl)ethan-1-one |
| Molecular Weight: | 438.5 |
| Molecular Formula: | C23 H27 F N6 O2 |
| Smiles: | C1CCC(C1)CC(N1CCC(CC1)c1nc(c2c(n1)n(Cc1ccccc1F)nn2)O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0286 |
| logD: | 2.5746 |
| logSw: | -3.0685 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.233 |
| InChI Key: | ZCVPBCBCIUFNGU-UHFFFAOYSA-N |