N-{1-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-(ethylsulfanyl)benzamide
Chemical Structure Depiction of
N-{1-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-(ethylsulfanyl)benzamide
N-{1-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-(ethylsulfanyl)benzamide
Compound characteristics
| Compound ID: | F614-0186 |
| Compound Name: | N-{1-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-(ethylsulfanyl)benzamide |
| Molecular Weight: | 489.99 |
| Molecular Formula: | C24 H20 Cl N7 O S |
| Smiles: | CCSc1ccccc1C(Nc1cc(C)nn1c1c2cnn(c3ccc(cc3)[Cl])c2ncn1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2031 |
| logD: | 5.1733 |
| logSw: | -5.4845 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.741 |
| InChI Key: | LTPLCUGRFDGZJJ-UHFFFAOYSA-N |