methyl 4-[([(3,4-dimethoxyphenyl)methyl]{3-[(2-ethyl-6-methylphenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}amino)methyl]benzoate
Chemical Structure Depiction of
methyl 4-[([(3,4-dimethoxyphenyl)methyl]{3-[(2-ethyl-6-methylphenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}amino)methyl]benzoate
methyl 4-[([(3,4-dimethoxyphenyl)methyl]{3-[(2-ethyl-6-methylphenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}amino)methyl]benzoate
Compound characteristics
| Compound ID: | K783-3676 |
| Compound Name: | methyl 4-[([(3,4-dimethoxyphenyl)methyl]{3-[(2-ethyl-6-methylphenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}amino)methyl]benzoate |
| Molecular Weight: | 634.72 |
| Molecular Formula: | C34 H35 F N2 O7 S |
| Smiles: | CCc1cccc(C)c1NC(c1cc(ccc1F)S(N(Cc1ccc(cc1)C(=O)OC)Cc1ccc(c(c1)OC)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9657 |
| logD: | 5.9629 |
| logSw: | -5.5427 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.473 |
| InChI Key: | SLNOGUQIIPFZTC-UHFFFAOYSA-N |