2-({N-[(4-fluorophenyl)methyl]-2-methylpropanamido}methyl)phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
2-({N-[(4-fluorophenyl)methyl]-2-methylpropanamido}methyl)phenyl 4-methoxybenzene-1-sulfonate
2-({N-[(4-fluorophenyl)methyl]-2-methylpropanamido}methyl)phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V025-5606 |
| Compound Name: | 2-({N-[(4-fluorophenyl)methyl]-2-methylpropanamido}methyl)phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 471.55 |
| Molecular Formula: | C25 H26 F N O5 S |
| Smiles: | CC(C)C(N(Cc1ccc(cc1)F)Cc1ccccc1OS(c1ccc(cc1)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8797 |
| logD: | 4.8797 |
| logSw: | -4.6169 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.841 |
| InChI Key: | MKMREGKVNRRKIE-UHFFFAOYSA-N |