5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methyl-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methyl-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidin-4(3H)-one
5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methyl-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C096-0056 |
| Compound Name: | 5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methyl-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 622.77 |
| Molecular Formula: | C30 H34 N6 O5 S2 |
| Smiles: | Cc1c(c2C(N(CC(N3CCN(CC3)c3ccccc3)=O)C=Nc2s1)=O)S(N1CCN(CC1)c1ccccc1OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5055 |
| logD: | 2.5054 |
| logSw: | -2.5261 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 88.195 |
| InChI Key: | BCUFKKLJNJQAEM-UHFFFAOYSA-N |