1-(2-methoxyphenyl)-6-[(3-phenylprop-2-en-1-yl)sulfanyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
1-(2-methoxyphenyl)-6-[(3-phenylprop-2-en-1-yl)sulfanyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
1-(2-methoxyphenyl)-6-[(3-phenylprop-2-en-1-yl)sulfanyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | G873-0167 |
| Compound Name: | 1-(2-methoxyphenyl)-6-[(3-phenylprop-2-en-1-yl)sulfanyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 390.46 |
| Molecular Formula: | C21 H18 N4 O2 S |
| Smiles: | COc1ccccc1n1c2c(cn1)C(NC(=N2)SC/C=C/c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3531 |
| logD: | 4.2756 |
| logSw: | -4.2711 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.781 |
| InChI Key: | IKZZWOFFAUFWJZ-UHFFFAOYSA-N |