2-cyano-N~1~-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-{1-[2-(3-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-(3-methoxyphenoxy)ethyl]-1H-indol-3-yl}acrylamide
2-cyano-N~1~-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-{1-[2-(3-methoxyphenoxy)ethyl]-1H-indol-3-yl}acrylamide
Compound characteristics
| Compound ID: | C356-0535 |
| Compound Name: | 2-cyano-N~1~-[5-(ethylsulfonyl)-1,3,4-thiadiazol-2-yl]-3-{1-[2-(3-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(CCOc3cccc(c3)OC)c3ccccc23)\C#N)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.39 |
| logD: | 1.6 |
| logSw: | -4.91 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 224.3 |
| InChI Key: | QEPLKBDUZPAHIM-UHFFFAOYSA-N |