ethyl 2-(2-{[2-(2,5-dioxopyrrolidin-1-yl)propanoyl]oxy}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(2-{[2-(2,5-dioxopyrrolidin-1-yl)propanoyl]oxy}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-(2-{[2-(2,5-dioxopyrrolidin-1-yl)propanoyl]oxy}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8006-4204 |
| Compound Name: | ethyl 2-(2-{[2-(2,5-dioxopyrrolidin-1-yl)propanoyl]oxy}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 436.48 |
| Molecular Formula: | C20 H24 N2 O7 S |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(COC(C(C)N1C(CCC1=O)=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2731 |
| logD: | -0.826 |
| logSw: | -2.0892 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.406 |
| InChI Key: | YKVAZRFFBXEBJU-NSHDSACASA-N |