methyl [5-(3,5-dimethylpiperidine-1-sulfonyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetate
Chemical Structure Depiction of
methyl [5-(3,5-dimethylpiperidine-1-sulfonyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetate
methyl [5-(3,5-dimethylpiperidine-1-sulfonyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetate
Compound characteristics
| Compound ID: | C066-1432 |
| Compound Name: | methyl [5-(3,5-dimethylpiperidine-1-sulfonyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetate |
| Molecular Weight: | 413.51 |
| Molecular Formula: | C17 H23 N3 O5 S2 |
| Smiles: | CC1CC(C)CN(C1)S(c1c2C(N(CC(=O)OC)C=Nc2sc1C)=O)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.663 |
| logD: | 1.663 |
| logSw: | -1.8956 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 78.67 |
| InChI Key: | DNQDMZVTJHKAEK-UHFFFAOYSA-N |