ethyl N-[(2E)-2-benzamido-3-(4-bromophenyl)prop-2-enoyl]threoninate
Chemical Structure Depiction of
ethyl N-[(2E)-2-benzamido-3-(4-bromophenyl)prop-2-enoyl]threoninate
ethyl N-[(2E)-2-benzamido-3-(4-bromophenyl)prop-2-enoyl]threoninate
Compound characteristics
| Compound ID: | 4055-0312 |
| Compound Name: | ethyl N-[(2E)-2-benzamido-3-(4-bromophenyl)prop-2-enoyl]threoninate |
| Molecular Weight: | 475.34 |
| Molecular Formula: | C22 H23 Br N2 O5 |
| Smiles: | CCOC(C(C(C)O)NC(/C(=C\c1ccc(cc1)[Br])NC(c1ccccc1)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.3037 |
| logD: | 2.4861 |
| logSw: | -3.4371 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.964 |
| InChI Key: | SYOXGLFPQKTXAY-UHFFFAOYSA-N |