4-(3-chloro-4-fluorophenyl)-2-phenyl-N~6~-[(pyridin-3-yl)methyl]-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine
Chemical Structure Depiction of
4-(3-chloro-4-fluorophenyl)-2-phenyl-N~6~-[(pyridin-3-yl)methyl]-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine
4-(3-chloro-4-fluorophenyl)-2-phenyl-N~6~-[(pyridin-3-yl)methyl]-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine
Compound characteristics
| Compound ID: | V028-3634 |
| Compound Name: | 4-(3-chloro-4-fluorophenyl)-2-phenyl-N~6~-[(pyridin-3-yl)methyl]-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine |
| Molecular Weight: | 445.89 |
| Molecular Formula: | C23 H17 Cl F N7 |
| Salt: | not_available |
| Smiles: | C(c1cccnc1)Nc1nc(c2ccc(c(c2)[Cl])F)c2c(n1)nn(c1ccccc1)c2N |
| Stereo: | ACHIRAL |
| logP: | 4.0402 |
| logD: | 3.9759 |
| logSw: | -4.5941 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 74.328 |
| InChI Key: | IOLRYVXOJDBTJA-UHFFFAOYSA-N |