4-(2H-1,3-benzodioxol-5-yl)-2-methyl-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-methyl-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-methyl-6-{4-[2-(morpholin-4-yl)ethyl]piperazin-1-yl}-2H-pyrazolo[3,4-d]pyrimidin-3-amine
Compound characteristics
| Compound ID: | V012-0141 |
| Compound Name: | 4-(2H-1,3-benzodioxol-5-yl)-2-methyl-6-{4-[2-(morpholin-4-yl)ethyl]piperazin-1-yl}-2H-pyrazolo[3,4-d]pyrimidin-3-amine |
| Molecular Weight: | 466.54 |
| Molecular Formula: | C23 H30 N8 O3 |
| Smiles: | Cn1c(c2c(c3ccc4c(c3)OCO4)nc(nc2n1)N1CCN(CCN2CCOCC2)CC1)N |
| Stereo: | ACHIRAL |
| logP: | 1.442 |
| logD: | 1.3771 |
| logSw: | -2.0065 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.768 |
| InChI Key: | ROQNTSCMUCPYKC-UHFFFAOYSA-N |