N-(1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[2-(morpholin-4-yl)ethyl]amino}-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-(1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[2-(morpholin-4-yl)ethyl]amino}-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide
N-(1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[2-(morpholin-4-yl)ethyl]amino}-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | D009-0146 |
| Compound Name: | N-(1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[2-(morpholin-4-yl)ethyl]amino}-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide |
| Molecular Weight: | 585.68 |
| Molecular Formula: | C28 H35 N5 O7 S |
| Smiles: | CN(C)S(n1cc(/C=C(/C(NCCN2CCOCC2)=O)NC(c2ccc(c(c2)OC)OC)=O)c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1116 |
| logD: | 0.486 |
| logSw: | -2.4374 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.921 |
| InChI Key: | SETSEABWUPBDRG-UHFFFAOYSA-N |