2-{[6,6-dimethyl-4-(2-oxo-2-phenylethoxy)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-1-phenylethan-1-one
Chemical Structure Depiction of
2-{[6,6-dimethyl-4-(2-oxo-2-phenylethoxy)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-1-phenylethan-1-one
2-{[6,6-dimethyl-4-(2-oxo-2-phenylethoxy)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-1-phenylethan-1-one
Compound characteristics
| Compound ID: | 5627-0363 |
| Compound Name: | 2-{[6,6-dimethyl-4-(2-oxo-2-phenylethoxy)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-1-phenylethan-1-one |
| Molecular Weight: | 504.63 |
| Molecular Formula: | C27 H24 N2 O4 S2 |
| Smiles: | CC1(C)Cc2c3c(nc(nc3sc2CO1)SCC(c1ccccc1)=O)OCC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7733 |
| logD: | 5.7733 |
| logSw: | -5.9222 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 60.461 |
| InChI Key: | HTOXVVPBAATQBV-UHFFFAOYSA-N |