2-{5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl}-N-[(pyridin-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-{5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl}-N-[(pyridin-2-yl)methyl]acetamide
2-{5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl}-N-[(pyridin-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | C096-0081 |
| Compound Name: | 2-{5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl}-N-[(pyridin-2-yl)methyl]acetamide |
| Molecular Weight: | 568.67 |
| Molecular Formula: | C26 H28 N6 O5 S2 |
| Smiles: | Cc1c(c2C(N(CC(NCc3ccccn3)=O)C=Nc2s1)=O)S(N1CCN(CC1)c1ccccc1OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5885 |
| logD: | 1.5875 |
| logSw: | -2.5062 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 102.557 |
| InChI Key: | RVGPVUMVNDLXDY-UHFFFAOYSA-N |