2-[6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]-N-[3-(pyrrolidin-1-yl)propyl]acetamide
Chemical Structure Depiction of
2-[6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]-N-[3-(pyrrolidin-1-yl)propyl]acetamide
2-[6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]-N-[3-(pyrrolidin-1-yl)propyl]acetamide
Compound characteristics
| Compound ID: | C096-0546 |
| Compound Name: | 2-[6-methyl-5-(4-methylpiperidine-1-sulfonyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]-N-[3-(pyrrolidin-1-yl)propyl]acetamide |
| Molecular Weight: | 495.66 |
| Molecular Formula: | C22 H33 N5 O4 S2 |
| Smiles: | CC1CCN(CC1)S(c1c2C(N(CC(NCCCN3CCCC3)=O)C=Nc2sc1C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0294 |
| logD: | -2.0611 |
| logSw: | -1.927 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.614 |
| InChI Key: | OOJDNHIQLRJLJV-UHFFFAOYSA-N |