2-[(2,6-dimethylphenoxy)methyl]-7-(4-methoxyphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-[(2,6-dimethylphenoxy)methyl]-7-(4-methoxyphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-[(2,6-dimethylphenoxy)methyl]-7-(4-methoxyphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | D049-0116 |
| Compound Name: | 2-[(2,6-dimethylphenoxy)methyl]-7-(4-methoxyphenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 400.44 |
| Molecular Formula: | C22 H20 N6 O2 |
| Smiles: | Cc1cccc(C)c1OCc1nc2c3cnn(c4ccc(cc4)OC)c3ncn2n1 |
| Stereo: | ACHIRAL |
| logP: | 4.2627 |
| logD: | 4.2613 |
| logSw: | -4.4087 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 60.648 |
| InChI Key: | XIVLUAINQHBGAW-UHFFFAOYSA-N |