2-({[(4-fluorophenyl)methyl](thiophene-2-carbonyl)amino}methyl)phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
2-({[(4-fluorophenyl)methyl](thiophene-2-carbonyl)amino}methyl)phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
2-({[(4-fluorophenyl)methyl](thiophene-2-carbonyl)amino}methyl)phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-9719 |
| Compound Name: | 2-({[(4-fluorophenyl)methyl](thiophene-2-carbonyl)amino}methyl)phenyl 3-fluoro-4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 529.58 |
| Molecular Formula: | C26 H21 F2 N O5 S2 |
| Smiles: | COc1ccc(cc1F)S(=O)(=O)Oc1ccccc1CN(Cc1ccc(cc1)F)C(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3574 |
| logD: | 5.3574 |
| logSw: | -5.3761 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.675 |
| InChI Key: | QIQHFEFNHDEQIZ-UHFFFAOYSA-N |