6-methyl-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-methyl-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-4(3H)-one
6-methyl-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C210-0047 |
| Compound Name: | 6-methyl-3-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 594.71 |
| Molecular Formula: | C27 H30 N8 O4 S2 |
| Smiles: | Cc1c(c2C(N(CC(N3CCN(CC3)c3ccccc3)=O)C=Nc2s1)=O)S(N1CCN(CC1)c1ncccn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6694 |
| logD: | 1.6694 |
| logSw: | -2.3305 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 99.228 |
| InChI Key: | UJCKSNODMWOTON-UHFFFAOYSA-N |