4-bromo-2-(7,8-dimethoxy-1-methyl-3-phenyl-3H-pyrazolo[3,4-c]isoquinolin-5-yl)phenol
Chemical Structure Depiction of
4-bromo-2-(7,8-dimethoxy-1-methyl-3-phenyl-3H-pyrazolo[3,4-c]isoquinolin-5-yl)phenol
4-bromo-2-(7,8-dimethoxy-1-methyl-3-phenyl-3H-pyrazolo[3,4-c]isoquinolin-5-yl)phenol
Compound characteristics
| Compound ID: | 4116-0078 |
| Compound Name: | 4-bromo-2-(7,8-dimethoxy-1-methyl-3-phenyl-3H-pyrazolo[3,4-c]isoquinolin-5-yl)phenol |
| Molecular Weight: | 490.36 |
| Molecular Formula: | C25 H20 Br N3 O3 |
| Smiles: | Cc1c2c3cc(c(cc3c(c3cc(ccc3O)[Br])nc2n(c2ccccc2)n1)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 6.1562 |
| logD: | 6.142 |
| logSw: | -5.8683 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.67 |
| InChI Key: | KTBCABSYGGZKGX-UHFFFAOYSA-N |