N-[3-(2H-1,3-benzodioxol-5-yl)-2-(2-bromobenzamido)prop-2-enoyl]glycine
Chemical Structure Depiction of
N-[3-(2H-1,3-benzodioxol-5-yl)-2-(2-bromobenzamido)prop-2-enoyl]glycine
N-[3-(2H-1,3-benzodioxol-5-yl)-2-(2-bromobenzamido)prop-2-enoyl]glycine
Compound characteristics
| Compound ID: | 4735-0105 |
| Compound Name: | N-[3-(2H-1,3-benzodioxol-5-yl)-2-(2-bromobenzamido)prop-2-enoyl]glycine |
| Molecular Weight: | 447.24 |
| Molecular Formula: | C19 H15 Br N2 O6 |
| Smiles: | C(C(O)=O)NC(/C(=C/c1ccc2c(c1)OCO2)NC(c1ccccc1[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5589 |
| logD: | -2.0763 |
| logSw: | -2.5206 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 92.347 |
| InChI Key: | OGIGGBPLNQCSKI-UHFFFAOYSA-N |