2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}-N-[(oxolan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}-N-[(oxolan-2-yl)methyl]acetamide
2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}-N-[(oxolan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | C210-0054 |
| Compound Name: | 2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}-N-[(oxolan-2-yl)methyl]acetamide |
| Molecular Weight: | 533.63 |
| Molecular Formula: | C22 H27 N7 O5 S2 |
| Smiles: | Cc1c(c2C(N(CC(NCC3CCCO3)=O)C=Nc2s1)=O)S(N1CCN(CC1)c1ncccn1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.1177 |
| logD: | 0.1177 |
| logSw: | -2.0131 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 112.701 |
| InChI Key: | MFEKXPJWYYNYOY-MRXNPFEDSA-N |