methyl 2-{4-[(5-tert-butyl-2,3-dimethylbenzene-1-sulfonyl)amino]benzamido}benzoate
Chemical Structure Depiction of
methyl 2-{4-[(5-tert-butyl-2,3-dimethylbenzene-1-sulfonyl)amino]benzamido}benzoate
methyl 2-{4-[(5-tert-butyl-2,3-dimethylbenzene-1-sulfonyl)amino]benzamido}benzoate
Compound characteristics
| Compound ID: | 6144-0722 |
| Compound Name: | methyl 2-{4-[(5-tert-butyl-2,3-dimethylbenzene-1-sulfonyl)amino]benzamido}benzoate |
| Molecular Weight: | 494.61 |
| Molecular Formula: | C27 H30 N2 O5 S |
| Smiles: | Cc1cc(cc(c1C)S(Nc1ccc(cc1)C(Nc1ccccc1C(=O)OC)=O)(=O)=O)C(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 6.2882 |
| logD: | 4.7878 |
| logSw: | -5.5359 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.455 |
| InChI Key: | CYSZYHXKKKGCOJ-UHFFFAOYSA-N |