N-(1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[3-(morpholin-4-yl)propyl]amino}-3-oxoprop-1-en-2-yl)-2-fluorobenzamide
Chemical Structure Depiction of
N-(1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[3-(morpholin-4-yl)propyl]amino}-3-oxoprop-1-en-2-yl)-2-fluorobenzamide
N-(1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[3-(morpholin-4-yl)propyl]amino}-3-oxoprop-1-en-2-yl)-2-fluorobenzamide
Compound characteristics
| Compound ID: | D009-0033 |
| Compound Name: | N-(1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[3-(morpholin-4-yl)propyl]amino}-3-oxoprop-1-en-2-yl)-2-fluorobenzamide |
| Molecular Weight: | 557.64 |
| Molecular Formula: | C27 H32 F N5 O5 S |
| Smiles: | CN(C)S(n1cc(/C=C(/C(NCCCN2CCOCC2)=O)NC(c2ccccc2F)=O)c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5935 |
| logD: | 1.5935 |
| logSw: | -2.5574 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.66 |
| InChI Key: | JPBGQXBUJJXFLE-UHFFFAOYSA-N |