3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methylthieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methylthieno[2,3-d]pyrimidin-4(3H)-one
3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methylthieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C096-0097 |
| Compound Name: | 3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methylthieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 573.73 |
| Molecular Formula: | C27 H35 N5 O5 S2 |
| Smiles: | CC1CC(C)CN(C1)C(CN1C=Nc2c(C1=O)c(c(C)s2)S(N1CCN(CC1)c1ccccc1OC)(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.7855 |
| logD: | 2.7855 |
| logSw: | -3.3595 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.801 |
| InChI Key: | JRUNHYWSOGELHN-UHFFFAOYSA-N |