2-benzyl-4-(3-chloro-4-fluorophenyl)-N~6~-ethyl-N~6~-methyl-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine
Chemical Structure Depiction of
2-benzyl-4-(3-chloro-4-fluorophenyl)-N~6~-ethyl-N~6~-methyl-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine
2-benzyl-4-(3-chloro-4-fluorophenyl)-N~6~-ethyl-N~6~-methyl-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine
Compound characteristics
| Compound ID: | V022-7617 |
| Compound Name: | 2-benzyl-4-(3-chloro-4-fluorophenyl)-N~6~-ethyl-N~6~-methyl-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine |
| Molecular Weight: | 410.88 |
| Molecular Formula: | C21 H20 Cl F N6 |
| Salt: | not_available |
| Smiles: | CCN(C)c1nc(c2ccc(c(c2)[Cl])F)c2c(n1)nn(Cc1ccccc1)c2N |
| Stereo: | ACHIRAL |
| logP: | 4.5544 |
| logD: | 4.5533 |
| logSw: | -4.7678 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.183 |
| InChI Key: | IZBQYZJVFFVWFF-UHFFFAOYSA-N |