3-[(4-ethylphenyl)methyl]-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-[(4-ethylphenyl)methyl]-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
3-[(4-ethylphenyl)methyl]-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F396-0622 |
| Compound Name: | 3-[(4-ethylphenyl)methyl]-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 478.63 |
| Molecular Formula: | C25 H26 N4 O2 S2 |
| Smiles: | CCc1ccc(CN2C(=Nc3c4cccnc4sc3C2=O)SCC(N2CCCCC2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8455 |
| logD: | 4.8455 |
| logSw: | -4.6404 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.064 |
| InChI Key: | IXWMABIESYIUSI-UHFFFAOYSA-N |