2-({1-[3-(ethoxycarbonyl)-4,5-dimethylthiophen-2-yl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid
Chemical Structure Depiction of
2-({1-[3-(ethoxycarbonyl)-4,5-dimethylthiophen-2-yl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid
2-({1-[3-(ethoxycarbonyl)-4,5-dimethylthiophen-2-yl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid
Compound characteristics
| Compound ID: | 3888-1173 |
| Compound Name: | 2-({1-[3-(ethoxycarbonyl)-4,5-dimethylthiophen-2-yl]-2,5-dioxopyrrolidin-3-yl}sulfanyl)benzoic acid |
| Molecular Weight: | 433.5 |
| Molecular Formula: | C20 H19 N O6 S2 |
| Smiles: | CCOC(c1c(C)c(C)sc1N1C(CC(C1=O)Sc1ccccc1C(O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1461 |
| logD: | 0.5347 |
| logSw: | -3.2414 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.388 |
| InChI Key: | FGRRWKJKTCQMOG-CQSZACIVSA-N |