2-chloro-N-(1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[2-(1H-indol-3-yl)ethyl]amino}-3-oxoprop-1-en-2-yl)benzamide
Chemical Structure Depiction of
2-chloro-N-(1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[2-(1H-indol-3-yl)ethyl]amino}-3-oxoprop-1-en-2-yl)benzamide
2-chloro-N-(1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[2-(1H-indol-3-yl)ethyl]amino}-3-oxoprop-1-en-2-yl)benzamide
Compound characteristics
| Compound ID: | D009-0054 |
| Compound Name: | 2-chloro-N-(1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[2-(1H-indol-3-yl)ethyl]amino}-3-oxoprop-1-en-2-yl)benzamide |
| Molecular Weight: | 590.1 |
| Molecular Formula: | C30 H28 Cl N5 O4 S |
| Smiles: | CN(C)S(n1cc(/C=C(/C(NCCc2c[nH]c3ccccc23)=O)NC(c2ccccc2[Cl])=O)c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.155 |
| logD: | 1.8142 |
| logSw: | -4.4408 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.64 |
| InChI Key: | OBGTUZWMUAQYMX-UHFFFAOYSA-N |