N-{1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-oxo-3-[(propan-2-yl)amino]prop-1-en-2-yl}-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-{1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-oxo-3-[(propan-2-yl)amino]prop-1-en-2-yl}-3,4,5-trimethoxybenzamide
N-{1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-oxo-3-[(propan-2-yl)amino]prop-1-en-2-yl}-3,4,5-trimethoxybenzamide
Compound characteristics
Compound ID: | D009-0162 |
Compound Name: | N-{1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-oxo-3-[(propan-2-yl)amino]prop-1-en-2-yl}-3,4,5-trimethoxybenzamide |
Molecular Weight: | 544.63 |
Molecular Formula: | C26 H32 N4 O7 S |
Smiles: | CC(C)NC(/C(=C/c1cn(c2ccccc12)S(N(C)C)(=O)=O)NC(c1cc(c(c(c1)OC)OC)OC)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.2849 |
logD: | 2.039 |
logSw: | -3.1626 |
Hydrogen bond acceptors count: | 12 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 102.151 |
InChI Key: | QOGIFZKLIBJKMX-UHFFFAOYSA-N |