3-{5-bromo-2-[2-(2-methylanilino)-2-oxoethoxy]phenyl}prop-2-enoic acid
Chemical Structure Depiction of
3-{5-bromo-2-[2-(2-methylanilino)-2-oxoethoxy]phenyl}prop-2-enoic acid
3-{5-bromo-2-[2-(2-methylanilino)-2-oxoethoxy]phenyl}prop-2-enoic acid
Compound characteristics
| Compound ID: | Y507-2956 |
| Compound Name: | 3-{5-bromo-2-[2-(2-methylanilino)-2-oxoethoxy]phenyl}prop-2-enoic acid |
| Molecular Weight: | 390.23 |
| Molecular Formula: | C18 H16 Br N O4 |
| Smiles: | Cc1ccccc1NC(COc1ccc(cc1/C=C/C(O)=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9097 |
| logD: | 1.1159 |
| logSw: | -3.8921 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.388 |
| InChI Key: | GZOVZELTPKDNLF-UHFFFAOYSA-N |