3-[2-(4-bromobenzamido)-3-(3-nitrophenyl)prop-2-enamido]benzoic acid
Chemical Structure Depiction of
3-[2-(4-bromobenzamido)-3-(3-nitrophenyl)prop-2-enamido]benzoic acid
3-[2-(4-bromobenzamido)-3-(3-nitrophenyl)prop-2-enamido]benzoic acid
Compound characteristics
| Compound ID: | 3379-2246 |
| Compound Name: | 3-[2-(4-bromobenzamido)-3-(3-nitrophenyl)prop-2-enamido]benzoic acid |
| Molecular Weight: | 510.3 |
| Molecular Formula: | C23 H16 Br N3 O6 |
| Smiles: | C(=C(/C(Nc1cccc(c1)C(O)=O)=O)NC(c1ccc(cc1)[Br])=O)/c1cccc(c1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.0414 |
| logD: | 2.1556 |
| logSw: | -4.7435 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 107.044 |
| InChI Key: | WYJPNNKJALLPIE-UHFFFAOYSA-N |