(4-{3-[(furan-2-yl)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-[(furan-2-yl)methyl]-7-hydroxy-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}piperidin-1-yl)(phenyl)methanone
(4-{3-[(furan-2-yl)methyl]-7-hydroxy-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}piperidin-1-yl)(phenyl)methanone
Compound characteristics
| Compound ID: | D023-0027 |
| Compound Name: | (4-{3-[(furan-2-yl)methyl]-7-hydroxy-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}piperidin-1-yl)(phenyl)methanone |
| Molecular Weight: | 404.43 |
| Molecular Formula: | C21 H20 N6 O3 |
| Smiles: | C1CN(CCC1c1nc(c2c(n1)n(Cc1ccco1)nn2)O)C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.689 |
| logD: | 1.235 |
| logSw: | -1.8603 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.951 |
| InChI Key: | GMGADZFDJFYYLU-UHFFFAOYSA-N |