2-{4-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}-7-methyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-{4-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}-7-methyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-{4-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}-7-methyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y502-4196 |
| Compound Name: | 2-{4-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}-7-methyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 437.3 |
| Molecular Formula: | C19 H17 Br N8 |
| Smiles: | Cc1c(c(C)n(Cc2ccc(cc2)c2nc3c4cnn(C)c4ncn3n2)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.4557 |
| logD: | 2.41 |
| logSw: | -2.2162 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 59.145 |
| InChI Key: | LTUMGPBFCJNURG-UHFFFAOYSA-N |