5-({([1,1'-biphenyl]-4-carbonyl)[(furan-2-yl)methyl]amino}methyl)-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
5-({([1,1'-biphenyl]-4-carbonyl)[(furan-2-yl)methyl]amino}methyl)-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate
5-({([1,1'-biphenyl]-4-carbonyl)[(furan-2-yl)methyl]amino}methyl)-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V002-1320 |
| Compound Name: | 5-({([1,1'-biphenyl]-4-carbonyl)[(furan-2-yl)methyl]amino}methyl)-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 621.63 |
| Molecular Formula: | C33 H26 F3 N O6 S |
| Smiles: | COc1ccc(CN(Cc2ccco2)C(c2ccc(cc2)c2ccccc2)=O)cc1OS(c1cccc(c1)C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6663 |
| logD: | 6.6663 |
| logSw: | -5.9615 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.134 |
| InChI Key: | JAGYLPCJKVIJJN-UHFFFAOYSA-N |