N-{3-[butyl(methyl)amino]-1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-oxoprop-1-en-2-yl}-4-methoxybenzamide
Chemical Structure Depiction of
N-{3-[butyl(methyl)amino]-1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-oxoprop-1-en-2-yl}-4-methoxybenzamide
N-{3-[butyl(methyl)amino]-1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-oxoprop-1-en-2-yl}-4-methoxybenzamide
Compound characteristics
| Compound ID: | D009-0129 |
| Compound Name: | N-{3-[butyl(methyl)amino]-1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-oxoprop-1-en-2-yl}-4-methoxybenzamide |
| Molecular Weight: | 512.63 |
| Molecular Formula: | C26 H32 N4 O5 S |
| Smiles: | CCCCN(C)C(/C(=C/c1cn(c2ccccc12)S(N(C)C)(=O)=O)NC(c1ccc(cc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.148 |
| logD: | 1.484 |
| logSw: | -3.4636 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.459 |
| InChI Key: | SHVHQMLTYVHNKT-UHFFFAOYSA-N |