5-({N-[(4-fluorophenyl)methyl]-2-methylpropanamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
5-({N-[(4-fluorophenyl)methyl]-2-methylpropanamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
5-({N-[(4-fluorophenyl)methyl]-2-methylpropanamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-4286 |
| Compound Name: | 5-({N-[(4-fluorophenyl)methyl]-2-methylpropanamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 489.54 |
| Molecular Formula: | C25 H25 F2 N O5 S |
| Smiles: | CC(C)C(N(Cc1ccc(cc1)F)Cc1ccc(c(c1)OS(c1ccc(cc1)F)(=O)=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4257 |
| logD: | 4.4257 |
| logSw: | -4.3945 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.928 |
| InChI Key: | YGKZJGGJKIZSOW-UHFFFAOYSA-N |