1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-[1-(3,4-dimethylphenyl)-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl]propan-1-one
Chemical Structure Depiction of
1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-[1-(3,4-dimethylphenyl)-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl]propan-1-one
1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-[1-(3,4-dimethylphenyl)-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl]propan-1-one
Compound characteristics
| Compound ID: | C561-2110 |
| Compound Name: | 1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-[1-(3,4-dimethylphenyl)-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl]propan-1-one |
| Molecular Weight: | 530.11 |
| Molecular Formula: | C31 H36 Cl N5 O |
| Smiles: | Cc1ccc(cc1C)n1c2c(c(C)c(CCC(N3CCN(CC3)c3cc(ccc3C)[Cl])=O)c(C)n2)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.8726 |
| logD: | 6.8602 |
| logSw: | -6.4054 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 43.291 |
| InChI Key: | QBBPIKFJHRKLLW-UHFFFAOYSA-N |