4-tert-butyl-N'-[1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]benzohydrazide
Chemical Structure Depiction of
4-tert-butyl-N'-[1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]benzohydrazide
4-tert-butyl-N'-[1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]benzohydrazide
Compound characteristics
Compound ID: | K405-3938 |
Compound Name: | 4-tert-butyl-N'-[1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]benzohydrazide |
Molecular Weight: | 420.9 |
Molecular Formula: | C22 H21 Cl N6 O |
Smiles: | CC(C)(C)c1ccc(cc1)C(NNc1c2cnn(c3cccc(c3)[Cl])c2ncn1)=O |
Stereo: | ACHIRAL |
logP: | 5.5742 |
logD: | 5.574 |
logSw: | -6.0017 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 72.132 |
InChI Key: | SNVKQKLYNLQNLU-UHFFFAOYSA-N |