N-{3-[bis(2-methylpropyl)amino]-1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-oxoprop-1-en-2-yl}-4-methylbenzamide
Chemical Structure Depiction of
N-{3-[bis(2-methylpropyl)amino]-1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-oxoprop-1-en-2-yl}-4-methylbenzamide
N-{3-[bis(2-methylpropyl)amino]-1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-oxoprop-1-en-2-yl}-4-methylbenzamide
Compound characteristics
| Compound ID: | D009-0086 |
| Compound Name: | N-{3-[bis(2-methylpropyl)amino]-1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-oxoprop-1-en-2-yl}-4-methylbenzamide |
| Molecular Weight: | 538.71 |
| Molecular Formula: | C29 H38 N4 O4 S |
| Smiles: | CC(C)CN(CC(C)C)C(/C(=C/c1cn(c2ccccc12)S(N(C)C)(=O)=O)NC(c1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1913 |
| logD: | 3.1492 |
| logSw: | -5.0553 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.997 |
| InChI Key: | WKMBIVRZAJOFQY-UHFFFAOYSA-N |