1-{4-[1-(3-chlorophenyl)-6-(3-methylbutyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}-2-phenylethan-1-one
Chemical Structure Depiction of
1-{4-[1-(3-chlorophenyl)-6-(3-methylbutyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}-2-phenylethan-1-one
1-{4-[1-(3-chlorophenyl)-6-(3-methylbutyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}-2-phenylethan-1-one
Compound characteristics
| Compound ID: | V021-7386 |
| Compound Name: | 1-{4-[1-(3-chlorophenyl)-6-(3-methylbutyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}-2-phenylethan-1-one |
| Molecular Weight: | 503.05 |
| Molecular Formula: | C28 H31 Cl N6 O |
| Salt: | not_available |
| Smiles: | CC(C)CCc1nc(c2cnn(c3cccc(c3)[Cl])c2n1)N1CCN(CC1)C(Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4995 |
| logD: | 6.3764 |
| logSw: | -6.2242 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53.541 |
| InChI Key: | RCKRDRRMPMSVLP-UHFFFAOYSA-N |