methyl 4-[2-(2-bromobenzamido)-3-(4-nitrophenyl)prop-2-enamido]benzoate
Chemical Structure Depiction of
methyl 4-[2-(2-bromobenzamido)-3-(4-nitrophenyl)prop-2-enamido]benzoate
methyl 4-[2-(2-bromobenzamido)-3-(4-nitrophenyl)prop-2-enamido]benzoate
Compound characteristics
| Compound ID: | 2628-3287 |
| Compound Name: | methyl 4-[2-(2-bromobenzamido)-3-(4-nitrophenyl)prop-2-enamido]benzoate |
| Molecular Weight: | 524.33 |
| Molecular Formula: | C24 H18 Br N3 O6 |
| Smiles: | COC(c1ccc(cc1)NC(/C(=C\c1ccc(cc1)[N+]([O-])=O)NC(c1ccccc1[Br])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.601 |
| logD: | 4.0471 |
| logSw: | -4.5392 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.81 |
| InChI Key: | KCATWNASXBEYAE-UHFFFAOYSA-N |