4-{[1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl][2-(4-methoxyphenyl)ethyl]amino}-4-oxobut-2-enoic acid
Chemical Structure Depiction of
4-{[1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl][2-(4-methoxyphenyl)ethyl]amino}-4-oxobut-2-enoic acid
4-{[1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl][2-(4-methoxyphenyl)ethyl]amino}-4-oxobut-2-enoic acid
Compound characteristics
| Compound ID: | 8008-7725 |
| Compound Name: | 4-{[1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl][2-(4-methoxyphenyl)ethyl]amino}-4-oxobut-2-enoic acid |
| Molecular Weight: | 501.33 |
| Molecular Formula: | C23 H21 Br N2 O6 |
| Smiles: | COc1ccc(CCN(C2CC(N(C2=O)c2ccc(cc2)[Br])=O)C(/C=C/C(O)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5162 |
| logD: | -1.3281 |
| logSw: | -2.4577 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.537 |
| InChI Key: | QYWDUJSTZZVDAU-LJQANCHMSA-N |