6-methyl-5-(4-methylpiperidine-1-sulfonyl)-3-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-methyl-5-(4-methylpiperidine-1-sulfonyl)-3-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}thieno[2,3-d]pyrimidin-4(3H)-one
6-methyl-5-(4-methylpiperidine-1-sulfonyl)-3-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C096-0505 |
| Compound Name: | 6-methyl-5-(4-methylpiperidine-1-sulfonyl)-3-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 530.67 |
| Molecular Formula: | C24 H30 N6 O4 S2 |
| Smiles: | CC1CCN(CC1)S(c1c2C(N(CC(N3CCN(CC3)c3ccccn3)=O)C=Nc2sc1C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9249 |
| logD: | 1.9161 |
| logSw: | -2.3479 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 86.116 |
| InChI Key: | YRBRHTTZVGUDSB-UHFFFAOYSA-N |