2-{[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}benzoic acid
Chemical Structure Depiction of
2-{[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}benzoic acid
2-{[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}benzoic acid
Compound characteristics
| Compound ID: | 3888-0573 |
| Compound Name: | 2-{[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}benzoic acid |
| Molecular Weight: | 357.38 |
| Molecular Formula: | C18 H15 N O5 S |
| Smiles: | COc1ccc(cc1)N1C(CC(C1=O)Sc1ccccc1C(O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1855 |
| logD: | -0.4259 |
| logSw: | -2.6703 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.109 |
| InChI Key: | XANJWJGQROHIQR-HNNXBMFYSA-N |