3-(2-ethylbutanamido)-N-[4-(ethylsulfamoyl)phenyl]benzamide
Chemical Structure Depiction of
3-(2-ethylbutanamido)-N-[4-(ethylsulfamoyl)phenyl]benzamide
3-(2-ethylbutanamido)-N-[4-(ethylsulfamoyl)phenyl]benzamide
Compound characteristics
Compound ID: | Y031-1018 |
Compound Name: | 3-(2-ethylbutanamido)-N-[4-(ethylsulfamoyl)phenyl]benzamide |
Molecular Weight: | 417.53 |
Molecular Formula: | C21 H27 N3 O4 S |
Smiles: | CCC(CC)C(Nc1cccc(c1)C(Nc1ccc(cc1)S(NCC)(=O)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.7271 |
logD: | 3.7068 |
logSw: | -3.9523 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 88.348 |
InChI Key: | MJYBGGGXBHOXEC-UHFFFAOYSA-N |