5-[(2-chlorophenyl)methyl]-3-[(5-phenyl-2H-tetrazol-2-yl)methyl]-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ol
Chemical Structure Depiction of
5-[(2-chlorophenyl)methyl]-3-[(5-phenyl-2H-tetrazol-2-yl)methyl]-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ol
5-[(2-chlorophenyl)methyl]-3-[(5-phenyl-2H-tetrazol-2-yl)methyl]-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ol
Compound characteristics
| Compound ID: | D112-0001 |
| Compound Name: | 5-[(2-chlorophenyl)methyl]-3-[(5-phenyl-2H-tetrazol-2-yl)methyl]-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ol |
| Molecular Weight: | 419.83 |
| Molecular Formula: | C19 H14 Cl N9 O |
| Smiles: | C(c1ccccc1[Cl])c1nc(c2c(n1)n(Cn1nc(c3ccccc3)nn1)nn2)O |
| Stereo: | ACHIRAL |
| logP: | 3.1162 |
| logD: | 1.3213 |
| logSw: | -3.224 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.341 |
| InChI Key: | FSIJBHARXWANCX-UHFFFAOYSA-N |