4-(2H-1,3-benzodioxol-5-yl)-2-(4-chlorophenyl)-6-{4-[2-(morpholin-4-yl)ethyl]piperazin-1-yl}-2H-pyrazolo[3,4-d]pyrimidin-3-amine
Chemical Structure Depiction of
4-(2H-1,3-benzodioxol-5-yl)-2-(4-chlorophenyl)-6-{4-[2-(morpholin-4-yl)ethyl]piperazin-1-yl}-2H-pyrazolo[3,4-d]pyrimidin-3-amine
4-(2H-1,3-benzodioxol-5-yl)-2-(4-chlorophenyl)-6-{4-[2-(morpholin-4-yl)ethyl]piperazin-1-yl}-2H-pyrazolo[3,4-d]pyrimidin-3-amine
Compound characteristics
| Compound ID: | V020-3237 |
| Compound Name: | 4-(2H-1,3-benzodioxol-5-yl)-2-(4-chlorophenyl)-6-{4-[2-(morpholin-4-yl)ethyl]piperazin-1-yl}-2H-pyrazolo[3,4-d]pyrimidin-3-amine |
| Molecular Weight: | 563.06 |
| Molecular Formula: | C28 H31 Cl N8 O3 |
| Salt: | not_available |
| Smiles: | C(CN1CCOCC1)N1CCN(CC1)c1nc(c2ccc3c(c2)OCO3)c2c(n1)nn(c1ccc(cc1)[Cl])c2N |
| Stereo: | ACHIRAL |
| logP: | 3.8009 |
| logD: | 3.736 |
| logSw: | -4.5947 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.347 |
| InChI Key: | UERCHVVSZSABIV-UHFFFAOYSA-N |