4-(2H-1,3-benzodioxol-5-yl)-6-([1,4'-bipiperidin]-1'-yl)-2-(4-chlorophenyl)-2H-pyrazolo[3,4-d]pyrimidin-3-amine
Chemical Structure Depiction of
4-(2H-1,3-benzodioxol-5-yl)-6-([1,4'-bipiperidin]-1'-yl)-2-(4-chlorophenyl)-2H-pyrazolo[3,4-d]pyrimidin-3-amine
4-(2H-1,3-benzodioxol-5-yl)-6-([1,4'-bipiperidin]-1'-yl)-2-(4-chlorophenyl)-2H-pyrazolo[3,4-d]pyrimidin-3-amine
Compound characteristics
| Compound ID: | V020-3217 |
| Compound Name: | 4-(2H-1,3-benzodioxol-5-yl)-6-([1,4'-bipiperidin]-1'-yl)-2-(4-chlorophenyl)-2H-pyrazolo[3,4-d]pyrimidin-3-amine |
| Molecular Weight: | 532.04 |
| Molecular Formula: | C28 H30 Cl N7 O2 |
| Salt: | not_available |
| Smiles: | C1CCN(CC1)C1CCN(CC1)c1nc(c2ccc3c(c2)OCO3)c2c(n1)nn(c1ccc(cc1)[Cl])c2N |
| Stereo: | ACHIRAL |
| logP: | 5.7662 |
| logD: | 3.074 |
| logSw: | -6.2178 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.03 |
| InChI Key: | XBVKJTSZACDOPU-UHFFFAOYSA-N |