pentyl {[3-(4-methoxyphenyl)-6,6-dimethyl-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
pentyl {[3-(4-methoxyphenyl)-6,6-dimethyl-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
pentyl {[3-(4-methoxyphenyl)-6,6-dimethyl-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | 3089-0044 |
| Compound Name: | pentyl {[3-(4-methoxyphenyl)-6,6-dimethyl-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate |
| Molecular Weight: | 502.65 |
| Molecular Formula: | C25 H30 N2 O5 S2 |
| Smiles: | CCCCCOC(CSC1=Nc2c(C(N1c1ccc(cc1)OC)=O)c1CC(C)(C)OCc1s2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4816 |
| logD: | 5.4816 |
| logSw: | -5.2764 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 60.948 |
| InChI Key: | GFEGMEDIQOAZJX-UHFFFAOYSA-N |