4-{[1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl](2-phenylethyl)amino}-4-oxobut-2-enoic acid
Chemical Structure Depiction of
4-{[1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl](2-phenylethyl)amino}-4-oxobut-2-enoic acid
4-{[1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl](2-phenylethyl)amino}-4-oxobut-2-enoic acid
Compound characteristics
| Compound ID: | 2743-0718 |
| Compound Name: | 4-{[1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl](2-phenylethyl)amino}-4-oxobut-2-enoic acid |
| Molecular Weight: | 471.31 |
| Molecular Formula: | C22 H19 Br N2 O5 |
| Smiles: | C(CN(C1CC(N(C1=O)c1ccc(cc1)[Br])=O)C(/C=C/C(O)=O)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5338 |
| logD: | -1.3105 |
| logSw: | -2.486 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.993 |
| InChI Key: | SQSHECBEQUHKAL-GOSISDBHSA-N |