ethyl N-benzyl-N-[3-(trifluoromethyl)benzene-1-sulfonyl]-beta-alaninate
Chemical Structure Depiction of
ethyl N-benzyl-N-[3-(trifluoromethyl)benzene-1-sulfonyl]-beta-alaninate
ethyl N-benzyl-N-[3-(trifluoromethyl)benzene-1-sulfonyl]-beta-alaninate
Compound characteristics
| Compound ID: | K783-3351 |
| Compound Name: | ethyl N-benzyl-N-[3-(trifluoromethyl)benzene-1-sulfonyl]-beta-alaninate |
| Molecular Weight: | 415.43 |
| Molecular Formula: | C19 H20 F3 N O4 S |
| Smiles: | CCOC(CCN(Cc1ccccc1)S(c1cccc(c1)C(F)(F)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2532 |
| logD: | 4.2532 |
| logSw: | -4.1824 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 51.751 |
| InChI Key: | KRCCMBXHBHDAJZ-UHFFFAOYSA-N |