N-(1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[2-(morpholin-4-yl)ethyl]amino}-3-oxoprop-1-en-2-yl)-4-methylbenzamide
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)-4-methylbenzamide
N-(1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[2-(morpholin-4-yl)ethyl]amino}-3-oxoprop-1-en-2-yl)-4-methylbenzamide
Compound characteristics
| Compound ID: | D009-0078 |
| Compound Name: | N-(1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[2-(morpholin-4-yl)ethyl]amino}-3-oxoprop-1-en-2-yl)-4-methylbenzamide |
| Molecular Weight: | 539.65 |
| Molecular Formula: | C27 H33 N5 O5 S |
| Smiles: | Cc1ccc(cc1)C(NC(=C/c1cn(c2ccccc12)S(N(C)C)(=O)=O)\C(NCCN1CCOCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9108 |
| logD: | 0.3775 |
| logSw: | -2.5111 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.66 |
| InChI Key: | WYPXDFGMIHTJBN-UHFFFAOYSA-N |