2-({N-[2-(dimethylamino)ethyl]-3-fluorobenzamido}methyl)phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
2-({N-[2-(dimethylamino)ethyl]-3-fluorobenzamido}methyl)phenyl 4-methoxybenzene-1-sulfonate
2-({N-[2-(dimethylamino)ethyl]-3-fluorobenzamido}methyl)phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V025-5845 |
| Compound Name: | 2-({N-[2-(dimethylamino)ethyl]-3-fluorobenzamido}methyl)phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 486.56 |
| Molecular Formula: | C25 H27 F N2 O5 S |
| Salt: | not_available |
| Smiles: | CN(C)CCN(Cc1ccccc1OS(c1ccc(cc1)OC)(=O)=O)C(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7866 |
| logD: | 3.4507 |
| logSw: | -3.9513 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.686 |
| InChI Key: | BYHLONXGPSQVKZ-UHFFFAOYSA-N |