{4-[3-methyl-6-(oxan-4-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}(thiophen-2-yl)methanone
Chemical Structure Depiction of
{4-[3-methyl-6-(oxan-4-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}(thiophen-2-yl)methanone
{4-[3-methyl-6-(oxan-4-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}(thiophen-2-yl)methanone
Compound characteristics
Compound ID: | V006-2976 |
Compound Name: | {4-[3-methyl-6-(oxan-4-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}(thiophen-2-yl)methanone |
Molecular Weight: | 488.61 |
Molecular Formula: | C26 H28 N6 O2 S |
Smiles: | Cc1c2c(nc(C3CCOCC3)nc2n(c2ccccc2)n1)N1CCN(CC1)C(c1cccs1)=O |
Stereo: | ACHIRAL |
logP: | 4.2938 |
logD: | 4.1477 |
logSw: | -4.3275 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 62.279 |
InChI Key: | XBWKSKVVHYCSAU-UHFFFAOYSA-N |