3-{1-[2-(4-chlorophenoxy)ethyl]-1H-indol-3-yl}-2-cyano-N~1~-[5-(methylsulfonyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
3-{1-[2-(4-chlorophenoxy)ethyl]-1H-indol-3-yl}-2-cyano-N~1~-[5-(methylsulfonyl)-1,3,4-thiadiazol-2-yl]acrylamide
3-{1-[2-(4-chlorophenoxy)ethyl]-1H-indol-3-yl}-2-cyano-N~1~-[5-(methylsulfonyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | C356-0135 |
| Compound Name: | 3-{1-[2-(4-chlorophenoxy)ethyl]-1H-indol-3-yl}-2-cyano-N~1~-[5-(methylsulfonyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 528.01 |
| Molecular Formula: | C23 H18 Cl N5 O4 S2 |
| Smiles: | CS(c1nnc(NC(C(=C/c2cn(CCOc3ccc(cc3)[Cl])c3ccccc23)\C#N)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.28 |
| logD: | 1.5 |
| logSw: | -4.59 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 215.1 |
| InChI Key: | RFFPPTGFSXGWSS-UHFFFAOYSA-N |