4-({N-[(4-fluorophenyl)methyl]-4-hexylbenzamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
4-({N-[(4-fluorophenyl)methyl]-4-hexylbenzamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
4-({N-[(4-fluorophenyl)methyl]-4-hexylbenzamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V011-2169 |
| Compound Name: | 4-({N-[(4-fluorophenyl)methyl]-4-hexylbenzamido}methyl)phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 577.69 |
| Molecular Formula: | C33 H33 F2 N O4 S |
| Smiles: | CCCCCCc1ccc(cc1)C(N(Cc1ccc(cc1)OS(c1ccc(cc1)F)(=O)=O)Cc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 8.0767 |
| logD: | 8.0767 |
| logSw: | -5.7224 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.939 |
| InChI Key: | NGHCCVCTMXDQMY-UHFFFAOYSA-N |