4-({tert-butyl-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl 2-(dimethylsulfamoyl)benzene-1-sulfonate
Chemical Structure Depiction of
4-({tert-butyl-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl 2-(dimethylsulfamoyl)benzene-1-sulfonate
4-({tert-butyl-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl 2-(dimethylsulfamoyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V030-6334 |
| Compound Name: | 4-({tert-butyl-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl 2-(dimethylsulfamoyl)benzene-1-sulfonate |
| Molecular Weight: | 553.7 |
| Molecular Formula: | C25 H35 N3 O7 S2 |
| Smiles: | CC(C)(C)NC(N(CC1CCCO1)Cc1ccc(cc1)OS(c1ccccc1S(N(C)C)(=O)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.731 |
| logD: | 2.7309 |
| logSw: | -3.2849 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.496 |
| InChI Key: | XGPVZLITKZNQGK-OAQYLSRUSA-N |