2-{[1-(2-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}benzoic acid
Chemical Structure Depiction of
2-{[1-(2-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}benzoic acid
2-{[1-(2-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}benzoic acid
Compound characteristics
| Compound ID: | 3888-0001 |
| Compound Name: | 2-{[1-(2-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}benzoic acid |
| Molecular Weight: | 371.41 |
| Molecular Formula: | C19 H17 N O5 S |
| Smiles: | CCOc1ccccc1N1C(CC(C1=O)Sc1ccccc1C(O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5176 |
| logD: | -0.0938 |
| logSw: | -2.668 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.475 |
| InChI Key: | XEMVDBIQBNWJJH-INIZCTEOSA-N |