4-({ethyl-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl 2-(dimethylsulfamoyl)benzene-1-sulfonate
Chemical Structure Depiction of
4-({ethyl-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl 2-(dimethylsulfamoyl)benzene-1-sulfonate
4-({ethyl-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl 2-(dimethylsulfamoyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V030-6345 |
| Compound Name: | 4-({ethyl-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl 2-(dimethylsulfamoyl)benzene-1-sulfonate |
| Molecular Weight: | 525.64 |
| Molecular Formula: | C23 H31 N3 O7 S2 |
| Smiles: | CCNC(N(CC1CCCO1)Cc1ccc(cc1)OS(c1ccccc1S(N(C)C)(=O)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6913 |
| logD: | 1.6913 |
| logSw: | -2.4885 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 104.298 |
| InChI Key: | HIBGJLSMTDEQIG-HXUWFJFHSA-N |