2-cyano-N~1~-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-{1-[2-(2-methoxyphenoxy)ethyl]-1H-indol-3-yl}acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-{1-[2-(2-methoxyphenoxy)ethyl]-1H-indol-3-yl}acrylamide
2-cyano-N~1~-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-{1-[2-(2-methoxyphenoxy)ethyl]-1H-indol-3-yl}acrylamide
Compound characteristics
| Compound ID: | C356-0532 |
| Compound Name: | 2-cyano-N~1~-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-{1-[2-(2-methoxyphenoxy)ethyl]-1H-indol-3-yl}acrylamide |
| Molecular Weight: | 537.62 |
| Molecular Formula: | C25 H23 N5 O5 S2 |
| Smiles: | CCS(c1nnc(NC(C(=C/c2cn(CCOc3ccccc3OC)c3ccccc23)\C#N)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.02 |
| logD: | 1.24 |
| logSw: | -4.69 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 209.62 |
| InChI Key: | YDFVUNDTCLVDRG-UHFFFAOYSA-N |