benzyl [6-(dimethylcarbamoyl)-3-(3-methoxyphenyl)-5-methyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl]acetate
Chemical Structure Depiction of
benzyl [6-(dimethylcarbamoyl)-3-(3-methoxyphenyl)-5-methyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl]acetate
benzyl [6-(dimethylcarbamoyl)-3-(3-methoxyphenyl)-5-methyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl]acetate
Compound characteristics
| Compound ID: | K305-0139 |
| Compound Name: | benzyl [6-(dimethylcarbamoyl)-3-(3-methoxyphenyl)-5-methyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl]acetate |
| Molecular Weight: | 507.56 |
| Molecular Formula: | C26 H25 N3 O6 S |
| Smiles: | Cc1c2C(N(C(N(CC(=O)OCc3ccccc3)c2sc1C(N(C)C)=O)=O)c1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0122 |
| logD: | 3.0122 |
| logSw: | -3.3439 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 75.186 |
| InChI Key: | NPMRPFVVPFWVGG-UHFFFAOYSA-N |