N-(3-chloro-4-fluorophenyl)-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
N-(3-chloro-4-fluorophenyl)-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Compound characteristics
| Compound ID: | K402-0258 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine |
| Molecular Weight: | 353.78 |
| Molecular Formula: | C18 H13 Cl F N5 |
| Smiles: | Cc1cccc(c1)n1c2c(cn1)c(Nc1ccc(c(c1)[Cl])F)ncn2 |
| Stereo: | ACHIRAL |
| logP: | 5.2923 |
| logD: | 5.2919 |
| logSw: | -6.0973 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.027 |
| InChI Key: | CGXJSKHCVGNWAI-UHFFFAOYSA-N |