ethyl 3-(benzylamino)-2-(3,4-dichloro-2,5-dihydroxyphenyl)but-2-enoate
Chemical Structure Depiction of
ethyl 3-(benzylamino)-2-(3,4-dichloro-2,5-dihydroxyphenyl)but-2-enoate
ethyl 3-(benzylamino)-2-(3,4-dichloro-2,5-dihydroxyphenyl)but-2-enoate
Compound characteristics
| Compound ID: | 4286-0197 |
| Compound Name: | ethyl 3-(benzylamino)-2-(3,4-dichloro-2,5-dihydroxyphenyl)but-2-enoate |
| Molecular Weight: | 396.27 |
| Molecular Formula: | C19 H19 Cl2 N O4 |
| Smiles: | CCOC(C(=C(/C)NCc1ccccc1)/c1cc(c(c(c1O)[Cl])[Cl])O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0299 |
| logD: | 4.8188 |
| logSw: | -4.5924 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 64.291 |
| InChI Key: | IXCXXQUMDQONSE-UHFFFAOYSA-N |