2-{3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}-8,9-dimethylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-{3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}-8,9-dimethylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
2-{3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}-8,9-dimethylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y503-1508 |
| Compound Name: | 2-{3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}-8,9-dimethylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 467.39 |
| Molecular Formula: | C21 H19 Br N6 S |
| Smiles: | Cc1c2c3nc(c4cccc(Cn5c(C)c(c(C)n5)[Br])c4)nn3cnc2sc1C |
| Stereo: | ACHIRAL |
| logP: | 4.5823 |
| logD: | 4.5738 |
| logSw: | -4.7656 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 45.401 |
| InChI Key: | IDQNDMVMCZNPMN-UHFFFAOYSA-N |