ethyl N-[(4-chlorophenyl)methyl]-N-(4-fluorobenzene-1-sulfonyl)-beta-alaninate
Chemical Structure Depiction of
ethyl N-[(4-chlorophenyl)methyl]-N-(4-fluorobenzene-1-sulfonyl)-beta-alaninate
ethyl N-[(4-chlorophenyl)methyl]-N-(4-fluorobenzene-1-sulfonyl)-beta-alaninate
Compound characteristics
| Compound ID: | K783-3240 |
| Compound Name: | ethyl N-[(4-chlorophenyl)methyl]-N-(4-fluorobenzene-1-sulfonyl)-beta-alaninate |
| Molecular Weight: | 399.87 |
| Molecular Formula: | C18 H19 Cl F N O4 S |
| Smiles: | CCOC(CCN(Cc1ccc(cc1)[Cl])S(c1ccc(cc1)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0538 |
| logD: | 4.0538 |
| logSw: | -4.3957 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 51.751 |
| InChI Key: | ZFSKRHMEXLMFSX-UHFFFAOYSA-N |