ethyl N-[(3,4-dimethoxyphenyl)methyl]-N-[3-(trifluoromethyl)benzene-1-sulfonyl]-beta-alaninate
Chemical Structure Depiction of
ethyl N-[(3,4-dimethoxyphenyl)methyl]-N-[3-(trifluoromethyl)benzene-1-sulfonyl]-beta-alaninate
ethyl N-[(3,4-dimethoxyphenyl)methyl]-N-[3-(trifluoromethyl)benzene-1-sulfonyl]-beta-alaninate
Compound characteristics
| Compound ID: | K783-3255 |
| Compound Name: | ethyl N-[(3,4-dimethoxyphenyl)methyl]-N-[3-(trifluoromethyl)benzene-1-sulfonyl]-beta-alaninate |
| Molecular Weight: | 475.48 |
| Molecular Formula: | C21 H24 F3 N O6 S |
| Smiles: | CCOC(CCN(Cc1ccc(c(c1)OC)OC)S(c1cccc(c1)C(F)(F)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8262 |
| logD: | 3.8262 |
| logSw: | -3.9902 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.012 |
| InChI Key: | IWOJWGMVHVIYPV-UHFFFAOYSA-N |