N-butyl-2-{5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl}-N-methylacetamide
Chemical Structure Depiction of
N-butyl-2-{5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl}-N-methylacetamide
N-butyl-2-{5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl}-N-methylacetamide
Compound characteristics
| Compound ID: | C096-0095 |
| Compound Name: | N-butyl-2-{5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl}-N-methylacetamide |
| Molecular Weight: | 547.7 |
| Molecular Formula: | C25 H33 N5 O5 S2 |
| Smiles: | CCCCN(C)C(CN1C=Nc2c(C1=O)c(c(C)s2)S(N1CCN(CC1)c1ccccc1OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0788 |
| logD: | 2.0787 |
| logSw: | -2.6187 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.687 |
| InChI Key: | KKXMDCKUHPHPCX-UHFFFAOYSA-N |