2-{1-[(2-bromo-4-chlorophenoxy)methyl]-1H-pyrazol-3-yl}-7-methyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-{1-[(2-bromo-4-chlorophenoxy)methyl]-1H-pyrazol-3-yl}-7-methyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-{1-[(2-bromo-4-chlorophenoxy)methyl]-1H-pyrazol-3-yl}-7-methyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y502-8998 |
| Compound Name: | 2-{1-[(2-bromo-4-chlorophenoxy)methyl]-1H-pyrazol-3-yl}-7-methyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 459.69 |
| Molecular Formula: | C17 H12 Br Cl N8 O |
| Smiles: | Cn1c2c(cn1)c1nc(c3ccn(COc4ccc(cc4[Br])[Cl])n3)nn1cn2 |
| Stereo: | ACHIRAL |
| logP: | 2.9702 |
| logD: | 2.97 |
| logSw: | -3.159 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 67.313 |
| InChI Key: | OATSIGNMWHNNCB-UHFFFAOYSA-N |