N-(1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[2-(morpholin-4-yl)ethyl]amino}-3-oxoprop-1-en-2-yl)-2-methoxybenzamide
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)-2-methoxybenzamide
N-(1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[2-(morpholin-4-yl)ethyl]amino}-3-oxoprop-1-en-2-yl)-2-methoxybenzamide
Compound characteristics
| Compound ID: | D009-0100 |
| Compound Name: | N-(1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[2-(morpholin-4-yl)ethyl]amino}-3-oxoprop-1-en-2-yl)-2-methoxybenzamide |
| Molecular Weight: | 555.65 |
| Molecular Formula: | C27 H33 N5 O6 S |
| Smiles: | CN(C)S(n1cc(/C=C(/C(NCCN2CCOCC2)=O)NC(c2ccccc2OC)=O)c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3124 |
| logD: | -1.391 |
| logSw: | -2.373 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.291 |
| InChI Key: | UNCNSFXODKWJSV-UHFFFAOYSA-N |