N-{1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-(4-methylpiperazin-1-yl)-3-oxoprop-1-en-2-yl}benzamide
Chemical Structure Depiction of
N-{1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-(4-methylpiperazin-1-yl)-3-oxoprop-1-en-2-yl}benzamide
N-{1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-(4-methylpiperazin-1-yl)-3-oxoprop-1-en-2-yl}benzamide
Compound characteristics
| Compound ID: | D009-0021 |
| Compound Name: | N-{1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-(4-methylpiperazin-1-yl)-3-oxoprop-1-en-2-yl}benzamide |
| Molecular Weight: | 495.6 |
| Molecular Formula: | C25 H29 N5 O4 S |
| Smiles: | CN1CCN(CC1)C(/C(=C/c1cn(c2ccccc12)S(N(C)C)(=O)=O)NC(c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8064 |
| logD: | -0.1365 |
| logSw: | -2.3967 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.639 |
| InChI Key: | QJFDGPGVEUWARS-UHFFFAOYSA-N |