N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[5-(dimethylsulfamoyl)-2-(trifluoromethyl)-1H-benzimidazol-1-yl]propanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[5-(dimethylsulfamoyl)-2-(trifluoromethyl)-1H-benzimidazol-1-yl]propanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[5-(dimethylsulfamoyl)-2-(trifluoromethyl)-1H-benzimidazol-1-yl]propanamide
Compound characteristics
| Compound ID: | F513-0395 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[5-(dimethylsulfamoyl)-2-(trifluoromethyl)-1H-benzimidazol-1-yl]propanamide |
| Molecular Weight: | 498.48 |
| Molecular Formula: | C21 H21 F3 N4 O5 S |
| Smiles: | CN(C)S(c1ccc2c(c1)nc(C(F)(F)F)n2CCC(NCc1ccc2c(c1)OCO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0004 |
| logD: | 3.0004 |
| logSw: | -3.5531 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.396 |
| InChI Key: | JKHWRTQUCZSXPJ-UHFFFAOYSA-N |