5-amino-6-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfanyl}-1-phenyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
5-amino-6-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfanyl}-1-phenyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
5-amino-6-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfanyl}-1-phenyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | 5672-0073 |
| Compound Name: | 5-amino-6-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfanyl}-1-phenyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 393.42 |
| Molecular Formula: | C19 H15 N5 O3 S |
| Smiles: | C1Oc2ccc(CSC3=Nc4c(cnn4c4ccccc4)C(N3N)=O)cc2O1 |
| Stereo: | ACHIRAL |
| logP: | 2.9502 |
| logD: | 2.9502 |
| logSw: | -3.4307 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.614 |
| InChI Key: | NNXAVPVRFBPVPE-UHFFFAOYSA-N |