N-(2H-1,3-benzodioxol-5-yl)-2-[6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-[6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-[6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetamide
Compound characteristics
| Compound ID: | C096-0508 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-[6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]acetamide |
| Molecular Weight: | 504.58 |
| Molecular Formula: | C22 H24 N4 O6 S2 |
| Smiles: | CC1CCN(CC1)S(c1c2C(N(CC(Nc3ccc4c(c3)OCO4)=O)C=Nc2sc1C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5054 |
| logD: | 2.5054 |
| logSw: | -3.0702 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.217 |
| InChI Key: | SYZPGMBREIPYLJ-UHFFFAOYSA-N |