N-{2-[(3,6-dimethyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)amino]ethyl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{2-[(3,6-dimethyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)amino]ethyl}-2H-1,3-benzodioxole-5-carboxamide
N-{2-[(3,6-dimethyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)amino]ethyl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V026-8032 |
| Compound Name: | N-{2-[(3,6-dimethyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)amino]ethyl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 430.47 |
| Molecular Formula: | C23 H22 N6 O3 |
| Salt: | not_available |
| Smiles: | Cc1c2c(NCCNC(c3ccc4c(c3)OCO4)=O)nc(C)nc2n(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.7796 |
| logD: | 2.6579 |
| logSw: | -3.5502 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.56 |
| InChI Key: | SXQNIACCFCIERA-UHFFFAOYSA-N |