7-tert-butyl-2-[3-oxo-3-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)propyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
7-tert-butyl-2-[3-oxo-3-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)propyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
7-tert-butyl-2-[3-oxo-3-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)propyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F145-0692 |
| Compound Name: | 7-tert-butyl-2-[3-oxo-3-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)propyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 475.65 |
| Molecular Formula: | C28 H33 N3 O2 S |
| Smiles: | CC(C)(C)C1CCc2c3C(NC(CCC(N4CCC(=CC4)c4ccccc4)=O)=Nc3sc2C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.623 |
| logD: | 5.6224 |
| logSw: | -5.5384 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.844 |
| InChI Key: | ONTNUWMBXHWXSM-HXUWFJFHSA-N |