4-{[1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl][2-(3,4-dimethoxyphenyl)ethyl]amino}-4-oxobut-2-enoic acid
Chemical Structure Depiction of
4-{[1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl][2-(3,4-dimethoxyphenyl)ethyl]amino}-4-oxobut-2-enoic acid
4-{[1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl][2-(3,4-dimethoxyphenyl)ethyl]amino}-4-oxobut-2-enoic acid
Compound characteristics
| Compound ID: | 8009-3492 |
| Compound Name: | 4-{[1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl][2-(3,4-dimethoxyphenyl)ethyl]amino}-4-oxobut-2-enoic acid |
| Molecular Weight: | 531.36 |
| Molecular Formula: | C24 H23 Br N2 O7 |
| Smiles: | COc1ccc(CCN(C2CC(N(C2=O)c2ccc(cc2)[Br])=O)C(/C=C/C(O)=O)=O)cc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0509 |
| logD: | -1.7934 |
| logSw: | -2.4247 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.254 |
| InChI Key: | IJRYMBZKZRNAEN-GOSISDBHSA-N |