ethyl 3-[3,5-dioxo-4-(2-phenylethyl)piperazine-1-sulfonyl]-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
ethyl 3-[3,5-dioxo-4-(2-phenylethyl)piperazine-1-sulfonyl]-1-benzothiophene-2-carboxylate
ethyl 3-[3,5-dioxo-4-(2-phenylethyl)piperazine-1-sulfonyl]-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | G226-0158 |
| Compound Name: | ethyl 3-[3,5-dioxo-4-(2-phenylethyl)piperazine-1-sulfonyl]-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 486.56 |
| Molecular Formula: | C23 H22 N2 O6 S2 |
| Smiles: | CCOC(c1c(c2ccccc2s1)S(N1CC(N(CCc2ccccc2)C(C1)=O)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7227 |
| logD: | 2.7227 |
| logSw: | -2.9947 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 82.817 |
| InChI Key: | MEYKOGFFASVJMV-UHFFFAOYSA-N |