2-{4-[(3-chlorophenoxy)methyl]phenyl}-7-methyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-{4-[(3-chlorophenoxy)methyl]phenyl}-7-methyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-{4-[(3-chlorophenoxy)methyl]phenyl}-7-methyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y502-5297 |
| Compound Name: | 2-{4-[(3-chlorophenoxy)methyl]phenyl}-7-methyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 390.83 |
| Molecular Formula: | C20 H15 Cl N6 O |
| Smiles: | Cn1c2c(cn1)c1nc(c3ccc(COc4cccc(c4)[Cl])cc3)nn1cn2 |
| Stereo: | ACHIRAL |
| logP: | 4.0326 |
| logD: | 3.9869 |
| logSw: | -4.2717 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 52.09 |
| InChI Key: | COLOBNZFRQMEOG-UHFFFAOYSA-N |