2-[5-(3,5-dimethylpiperidine-1-sulfonyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]-N-[(pyridin-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-[5-(3,5-dimethylpiperidine-1-sulfonyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]-N-[(pyridin-2-yl)methyl]acetamide
2-[5-(3,5-dimethylpiperidine-1-sulfonyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]-N-[(pyridin-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | C186-0444 |
| Compound Name: | 2-[5-(3,5-dimethylpiperidine-1-sulfonyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]-N-[(pyridin-2-yl)methyl]acetamide |
| Molecular Weight: | 489.61 |
| Molecular Formula: | C22 H27 N5 O4 S2 |
| Smiles: | CC1CC(C)CN(C1)S(c1c2C(N(CC(NCc3ccccn3)=O)C=Nc2sc1C)=O)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.8254 |
| logD: | 1.8245 |
| logSw: | -2.5348 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.834 |
| InChI Key: | MHZZXKYDKQGNNN-UHFFFAOYSA-N |