2-({N-[(furan-2-yl)methyl]-2-methylpropanamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
2-({N-[(furan-2-yl)methyl]-2-methylpropanamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
2-({N-[(furan-2-yl)methyl]-2-methylpropanamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-8737 |
| Compound Name: | 2-({N-[(furan-2-yl)methyl]-2-methylpropanamido}methyl)phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 431.48 |
| Molecular Formula: | C22 H22 F N O5 S |
| Smiles: | CC(C)C(N(Cc1ccccc1OS(c1ccc(cc1)F)(=O)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4277 |
| logD: | 4.4277 |
| logSw: | -4.3543 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.046 |
| InChI Key: | OBSPOOSHEARMKE-UHFFFAOYSA-N |