benzyl [3-(3-methoxyphenyl)-5,6-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl]acetate
Chemical Structure Depiction of
benzyl [3-(3-methoxyphenyl)-5,6-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl]acetate
benzyl [3-(3-methoxyphenyl)-5,6-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl]acetate
Compound characteristics
| Compound ID: | C242-0477 |
| Compound Name: | benzyl [3-(3-methoxyphenyl)-5,6-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl]acetate |
| Molecular Weight: | 450.51 |
| Molecular Formula: | C24 H22 N2 O5 S |
| Smiles: | Cc1c2C(N(C(N(CC(=O)OCc3ccccc3)c2sc1C)=O)c1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4641 |
| logD: | 4.4641 |
| logSw: | -4.7934 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.185 |
| InChI Key: | IQJURQMOIWKZHT-UHFFFAOYSA-N |