5-{[(butan-2-yl)(methoxyacetyl)amino]methyl}-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
5-{[(butan-2-yl)(methoxyacetyl)amino]methyl}-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate
5-{[(butan-2-yl)(methoxyacetyl)amino]methyl}-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-4344 |
| Compound Name: | 5-{[(butan-2-yl)(methoxyacetyl)amino]methyl}-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 478.56 |
| Molecular Formula: | C23 H30 N2 O7 S |
| Smiles: | CCC(C)N(Cc1ccc(c(c1)OS(c1ccc(cc1)NC(C)=O)(=O)=O)OC)C(COC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1899 |
| logD: | 2.1898 |
| logSw: | -2.9522 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.686 |
| InChI Key: | IIQODCRWKOMJEG-INIZCTEOSA-N |