ethyl N-(4-fluorobenzene-1-sulfonyl)-N-[(thiophen-2-yl)methyl]-beta-alaninate
Chemical Structure Depiction of
ethyl N-(4-fluorobenzene-1-sulfonyl)-N-[(thiophen-2-yl)methyl]-beta-alaninate
ethyl N-(4-fluorobenzene-1-sulfonyl)-N-[(thiophen-2-yl)methyl]-beta-alaninate
Compound characteristics
| Compound ID: | K783-3227 |
| Compound Name: | ethyl N-(4-fluorobenzene-1-sulfonyl)-N-[(thiophen-2-yl)methyl]-beta-alaninate |
| Molecular Weight: | 371.45 |
| Molecular Formula: | C16 H18 F N O4 S2 |
| Smiles: | CCOC(CCN(Cc1cccs1)S(c1ccc(cc1)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2474 |
| logD: | 3.2474 |
| logSw: | -3.3894 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.769 |
| InChI Key: | RIFRIEOIRXOTJV-UHFFFAOYSA-N |