methyl 4-[([(3,4-dimethoxyphenyl)methyl]{4-fluoro-3-[(3-methylphenyl)carbamoyl]benzene-1-sulfonyl}amino)methyl]benzoate
Chemical Structure Depiction of
methyl 4-[([(3,4-dimethoxyphenyl)methyl]{4-fluoro-3-[(3-methylphenyl)carbamoyl]benzene-1-sulfonyl}amino)methyl]benzoate
methyl 4-[([(3,4-dimethoxyphenyl)methyl]{4-fluoro-3-[(3-methylphenyl)carbamoyl]benzene-1-sulfonyl}amino)methyl]benzoate
Compound characteristics
| Compound ID: | K783-3683 |
| Compound Name: | methyl 4-[([(3,4-dimethoxyphenyl)methyl]{4-fluoro-3-[(3-methylphenyl)carbamoyl]benzene-1-sulfonyl}amino)methyl]benzoate |
| Molecular Weight: | 606.67 |
| Molecular Formula: | C32 H31 F N2 O7 S |
| Smiles: | Cc1cccc(c1)NC(c1cc(ccc1F)S(N(Cc1ccc(cc1)C(=O)OC)Cc1ccc(c(c1)OC)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7944 |
| logD: | 5.7926 |
| logSw: | -5.5413 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.868 |
| InChI Key: | QEOCAZVARVCJHS-UHFFFAOYSA-N |