2-({N-[(4-fluorophenyl)methyl]-2-methylpropanamido}methyl)phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
2-({N-[(4-fluorophenyl)methyl]-2-methylpropanamido}methyl)phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
2-({N-[(4-fluorophenyl)methyl]-2-methylpropanamido}methyl)phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-6816 |
| Compound Name: | 2-({N-[(4-fluorophenyl)methyl]-2-methylpropanamido}methyl)phenyl 3-fluoro-4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 489.54 |
| Molecular Formula: | C25 H25 F2 N O5 S |
| Smiles: | CC(C)C(N(Cc1ccc(cc1)F)Cc1ccccc1OS(c1ccc(c(c1)F)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8527 |
| logD: | 4.8527 |
| logSw: | -4.6755 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.928 |
| InChI Key: | COLGDBCJYQCCLZ-UHFFFAOYSA-N |