benzyl {3-[(4-{[(furan-2-yl)methyl]carbamoyl}phenyl)methyl]-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl}acetate
Chemical Structure Depiction of
benzyl {3-[(4-{[(furan-2-yl)methyl]carbamoyl}phenyl)methyl]-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl}acetate
benzyl {3-[(4-{[(furan-2-yl)methyl]carbamoyl}phenyl)methyl]-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl}acetate
Compound characteristics
| Compound ID: | C241-2089 |
| Compound Name: | benzyl {3-[(4-{[(furan-2-yl)methyl]carbamoyl}phenyl)methyl]-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl}acetate |
| Molecular Weight: | 529.57 |
| Molecular Formula: | C28 H23 N3 O6 S |
| Smiles: | C(c1ccco1)NC(c1ccc(CN2C(c3c(ccs3)N(CC(=O)OCc3ccccc3)C2=O)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5614 |
| logD: | 4.5614 |
| logSw: | -4.6808 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.982 |
| InChI Key: | PLQDXYWWOAHMIZ-UHFFFAOYSA-N |