N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[5-(3,5-dimethylpiperidine-1-sulfonyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[5-(3,5-dimethylpiperidine-1-sulfonyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[5-(3,5-dimethylpiperidine-1-sulfonyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetamide
Compound characteristics
| Compound ID: | C186-0401 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[5-(3,5-dimethylpiperidine-1-sulfonyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetamide |
| Molecular Weight: | 532.64 |
| Molecular Formula: | C24 H28 N4 O6 S2 |
| Smiles: | CC1CC(C)CN(C1)S(c1c2C(N(CC(Nc3ccc4c(c3)OCCO4)=O)C=Nc2sc1C)=O)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.1301 |
| logD: | 2.1301 |
| logSw: | -3.0756 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.791 |
| InChI Key: | GEOZEZHBUVZSNV-UHFFFAOYSA-N |