ethyl 4-{[1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}benzoate
ethyl 4-{[1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}benzoate
Compound characteristics
| Compound ID: | 4333-2374 |
| Compound Name: | ethyl 4-{[1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}benzoate |
| Molecular Weight: | 373.41 |
| Molecular Formula: | C21 H19 N5 O2 |
| Smiles: | CCOC(c1ccc(cc1)Nc1c2cnn(c3ccc(C)cc3)c2ncn1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0935 |
| logD: | 5.0934 |
| logSw: | -4.7558 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.781 |
| InChI Key: | PPUVITCMISRZSL-UHFFFAOYSA-N |