3-benzyl-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-6-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Chemical Structure Depiction of
3-benzyl-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-6-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
3-benzyl-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-6-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | F841-1024 |
| Compound Name: | 3-benzyl-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-6-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one |
| Molecular Weight: | 458.58 |
| Molecular Formula: | C26 H26 N4 O2 S |
| Smiles: | C1CCN(CC1)C(CSC1=Nc2cc(c3ccccc3)[nH]c2C(N1Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6024 |
| logD: | 4.6024 |
| logSw: | -4.2736 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.387 |
| InChI Key: | XAZRHGSSKWLLFU-UHFFFAOYSA-N |