3-chloro-1-{4-[6-(cyclohexylmethyl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}propan-1-one
Chemical Structure Depiction of
3-chloro-1-{4-[6-(cyclohexylmethyl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}propan-1-one
3-chloro-1-{4-[6-(cyclohexylmethyl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}propan-1-one
Compound characteristics
| Compound ID: | V009-7504 |
| Compound Name: | 3-chloro-1-{4-[6-(cyclohexylmethyl)-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}propan-1-one |
| Molecular Weight: | 499.03 |
| Molecular Formula: | C26 H32 Cl F N6 O |
| Smiles: | Cc1c2c(nc(CC3CCCCC3)nc2n(c2ccc(cc2)F)n1)N1CCN(CC1)C(CC[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2476 |
| logD: | 4.5571 |
| logSw: | -5.2324 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.086 |
| InChI Key: | WKZSIOCYYVGFJM-UHFFFAOYSA-N |