2-[(2,6-dimethylphenoxy)methyl]-7-(4-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-[(2,6-dimethylphenoxy)methyl]-7-(4-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-[(2,6-dimethylphenoxy)methyl]-7-(4-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | D049-0053 |
| Compound Name: | 2-[(2,6-dimethylphenoxy)methyl]-7-(4-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 384.44 |
| Molecular Formula: | C22 H20 N6 O |
| Smiles: | Cc1ccc(cc1)n1c2c(cn1)c1nc(COc3c(C)cccc3C)nn1cn2 |
| Stereo: | ACHIRAL |
| logP: | 4.7037 |
| logD: | 4.7023 |
| logSw: | -4.5034 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53.104 |
| InChI Key: | QSCDBCUSRDUQLD-UHFFFAOYSA-N |