2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-3-[(4-propoxyphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-3-[(4-propoxyphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-3-[(4-propoxyphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F396-0648 |
| Compound Name: | 2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-3-[(4-propoxyphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 508.66 |
| Molecular Formula: | C26 H28 N4 O3 S2 |
| Smiles: | CCCOc1ccc(CN2C(=Nc3c4cccnc4sc3C2=O)SCC(N2CCCCC2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8742 |
| logD: | 4.8742 |
| logSw: | -4.6252 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.482 |
| InChI Key: | AGNQXLQNMHOOQI-UHFFFAOYSA-N |