4-({(4-ethoxyphenyl)-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl methanesulfonate
Chemical Structure Depiction of
4-({(4-ethoxyphenyl)-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl methanesulfonate
4-({(4-ethoxyphenyl)-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl methanesulfonate
Compound characteristics
| Compound ID: | V011-9338 |
| Compound Name: | 4-({(4-ethoxyphenyl)-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl methanesulfonate |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C22 H28 N2 O6 S |
| Smiles: | CCOc1ccc(cc1)NC(N(CC1CCCO1)Cc1ccc(cc1)OS(C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.848 |
| logD: | 2.848 |
| logSw: | -3.4894 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.925 |
| InChI Key: | SYODAPFEPFAWAD-OAQYLSRUSA-N |