5-methyl-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-7-phenyl-3-propyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Chemical Structure Depiction of
5-methyl-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-7-phenyl-3-propyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
5-methyl-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-7-phenyl-3-propyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | L104-0103 |
| Compound Name: | 5-methyl-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-7-phenyl-3-propyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one |
| Molecular Weight: | 424.56 |
| Molecular Formula: | C23 H28 N4 O2 S |
| Smiles: | CCCN1C(=Nc2c(cn(C)c2C1=O)c1ccccc1)SCC(N1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6374 |
| logD: | 3.6374 |
| logSw: | -3.5776 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.587 |
| InChI Key: | XKODUSHJKDWJQB-UHFFFAOYSA-N |