N~4~-(3-chloro-4-methoxyphenyl)-N~6~-(4-fluorophenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine
Chemical Structure Depiction of
N~4~-(3-chloro-4-methoxyphenyl)-N~6~-(4-fluorophenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine
N~4~-(3-chloro-4-methoxyphenyl)-N~6~-(4-fluorophenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine
Compound characteristics
| Compound ID: | E781-0232 |
| Compound Name: | N~4~-(3-chloro-4-methoxyphenyl)-N~6~-(4-fluorophenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine |
| Molecular Weight: | 398.83 |
| Molecular Formula: | C19 H16 Cl F N6 O |
| Smiles: | Cn1c2c(cn1)c(Nc1ccc(c(c1)[Cl])OC)nc(Nc1ccc(cc1)F)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.8352 |
| logD: | 4.8059 |
| logSw: | -5.0414 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.887 |
| InChI Key: | JENREQVTRMLPIP-UHFFFAOYSA-N |