5-(4-bromophenyl)-6-{[(3-bromophenyl)methyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
5-(4-bromophenyl)-6-{[(3-bromophenyl)methyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
5-(4-bromophenyl)-6-{[(3-bromophenyl)methyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | K829-0177 |
| Compound Name: | 5-(4-bromophenyl)-6-{[(3-bromophenyl)methyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 492.19 |
| Molecular Formula: | C18 H12 Br2 N4 O S |
| Smiles: | C(c1cccc(c1)[Br])SC1=Nc2c(cn[nH]2)C(N1c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.7525 |
| logD: | 4.7507 |
| logSw: | -4.6285 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.426 |
| InChI Key: | LXAQRPFDEBYLHT-UHFFFAOYSA-N |