methyl 4-({[(3,4-dimethoxyphenyl)methyl](2-fluoro-5-{[3-(trifluoromethyl)phenyl]carbamoyl}benzene-1-sulfonyl)amino}methyl)benzoate
Chemical Structure Depiction of
methyl 4-({[(3,4-dimethoxyphenyl)methyl](2-fluoro-5-{[3-(trifluoromethyl)phenyl]carbamoyl}benzene-1-sulfonyl)amino}methyl)benzoate
methyl 4-({[(3,4-dimethoxyphenyl)methyl](2-fluoro-5-{[3-(trifluoromethyl)phenyl]carbamoyl}benzene-1-sulfonyl)amino}methyl)benzoate
Compound characteristics
| Compound ID: | K783-3661 |
| Compound Name: | methyl 4-({[(3,4-dimethoxyphenyl)methyl](2-fluoro-5-{[3-(trifluoromethyl)phenyl]carbamoyl}benzene-1-sulfonyl)amino}methyl)benzoate |
| Molecular Weight: | 660.64 |
| Molecular Formula: | C32 H28 F4 N2 O7 S |
| Smiles: | COC(c1ccc(CN(Cc2ccc(c(c2)OC)OC)S(c2cc(ccc2F)C(Nc2cccc(c2)C(F)(F)F)=O)(=O)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3511 |
| logD: | 5.9428 |
| logSw: | -5.7679 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.868 |
| InChI Key: | DJMPXWRTWXCGSW-UHFFFAOYSA-N |