7-benzyl-2-[(2-methylphenoxy)methyl]-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
7-benzyl-2-[(2-methylphenoxy)methyl]-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
7-benzyl-2-[(2-methylphenoxy)methyl]-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | D049-0029 |
| Compound Name: | 7-benzyl-2-[(2-methylphenoxy)methyl]-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 370.41 |
| Molecular Formula: | C21 H18 N6 O |
| Smiles: | Cc1ccccc1OCc1nc2c3cnn(Cc4ccccc4)c3ncn2n1 |
| Stereo: | ACHIRAL |
| logP: | 3.4421 |
| logD: | 3.4417 |
| logSw: | -3.3154 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 52.882 |
| InChI Key: | JANAKKOZTXXWFL-UHFFFAOYSA-N |