2-chloro-N-(1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[3-(1H-imidazol-1-yl)propyl]amino}-3-oxoprop-1-en-2-yl)benzamide
Chemical Structure Depiction of
2-chloro-N-(1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[3-(1H-imidazol-1-yl)propyl]amino}-3-oxoprop-1-en-2-yl)benzamide
2-chloro-N-(1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[3-(1H-imidazol-1-yl)propyl]amino}-3-oxoprop-1-en-2-yl)benzamide
Compound characteristics
| Compound ID: | D009-0057 |
| Compound Name: | 2-chloro-N-(1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[3-(1H-imidazol-1-yl)propyl]amino}-3-oxoprop-1-en-2-yl)benzamide |
| Molecular Weight: | 555.05 |
| Molecular Formula: | C26 H27 Cl N6 O4 S |
| Smiles: | CN(C)S(n1cc(/C=C(/C(NCCCn2ccnc2)=O)NC(c2ccccc2[Cl])=O)c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1178 |
| logD: | -0.2436 |
| logSw: | -3.2953 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.57 |
| InChI Key: | GODCVVYKNQBKOV-UHFFFAOYSA-N |