4-({(2-ethylphenyl)-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
4-({(2-ethylphenyl)-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
4-({(2-ethylphenyl)-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V003-3134 |
| Compound Name: | 4-({(2-ethylphenyl)-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 558.58 |
| Molecular Formula: | C28 H25 F3 N2 O5 S |
| Smiles: | CCc1ccccc1NC(N(Cc1ccc(cc1)OS(c1cccc(c1)C(F)(F)F)(=O)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5042 |
| logD: | 6.5042 |
| logSw: | -5.7021 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.811 |
| InChI Key: | ZEGZNNWROWDUFD-UHFFFAOYSA-N |