3-[(2,6-dimethylphenoxy)methyl]-7-(3-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Chemical Structure Depiction of
3-[(2,6-dimethylphenoxy)methyl]-7-(3-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
3-[(2,6-dimethylphenoxy)methyl]-7-(3-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Compound characteristics
| Compound ID: | 5506-0193 |
| Compound Name: | 3-[(2,6-dimethylphenoxy)methyl]-7-(3-methylphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine |
| Molecular Weight: | 384.44 |
| Molecular Formula: | C22 H20 N6 O |
| Smiles: | Cc1cccc(c1)n1c2c(cn1)c1nnc(COc3c(C)cccc3C)n1cn2 |
| Stereo: | ACHIRAL |
| logP: | 4.3178 |
| logD: | 4.3178 |
| logSw: | -4.3507 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53.558 |
| InChI Key: | KBFDCHPWUPDEDF-UHFFFAOYSA-N |