N-{3-[butyl(methyl)amino]-1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-oxoprop-1-en-2-yl}-4-methylbenzamide
Chemical Structure Depiction of
N-{3-[butyl(methyl)amino]-1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-oxoprop-1-en-2-yl}-4-methylbenzamide
N-{3-[butyl(methyl)amino]-1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-oxoprop-1-en-2-yl}-4-methylbenzamide
Compound characteristics
| Compound ID: | D009-0084 |
| Compound Name: | N-{3-[butyl(methyl)amino]-1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-oxoprop-1-en-2-yl}-4-methylbenzamide |
| Molecular Weight: | 496.63 |
| Molecular Formula: | C26 H32 N4 O4 S |
| Smiles: | CCCCN(C)C(/C(=C/c1cn(c2ccccc12)S(N(C)C)(=O)=O)NC(c1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.589 |
| logD: | 1.5265 |
| logSw: | -3.6362 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.915 |
| InChI Key: | YTKMWLOWXCKQLF-UHFFFAOYSA-N |