2-[5-(3,5-dimethylpiperidine-1-sulfonyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]-N-(3,4,5-trimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-[5-(3,5-dimethylpiperidine-1-sulfonyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]-N-(3,4,5-trimethoxyphenyl)acetamide
2-[5-(3,5-dimethylpiperidine-1-sulfonyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]-N-(3,4,5-trimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C186-0396 |
| Compound Name: | 2-[5-(3,5-dimethylpiperidine-1-sulfonyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]-N-(3,4,5-trimethoxyphenyl)acetamide |
| Molecular Weight: | 564.68 |
| Molecular Formula: | C25 H32 N4 O7 S2 |
| Smiles: | CC1CC(C)CN(C1)S(c1c2C(N(CC(Nc3cc(c(c(c3)OC)OC)OC)=O)C=Nc2sc1C)=O)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.5381 |
| logD: | 2.5378 |
| logSw: | -2.8862 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.946 |
| InChI Key: | IZYGSSDNCRHTIB-UHFFFAOYSA-N |