N-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide
N-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | D009-0144 |
| Compound Name: | N-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide |
| Molecular Weight: | 636.72 |
| Molecular Formula: | C32 H36 N4 O8 S |
| Smiles: | CN(C)S(n1cc(/C=C(/C(NCCc2ccc(c(c2)OC)OC)=O)NC(c2ccc(c(c2)OC)OC)=O)c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4899 |
| logD: | 1.88 |
| logSw: | -3.0906 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 110.291 |
| InChI Key: | JZEDOPYHTXSOCT-UHFFFAOYSA-N |