2-cyano-3-{1-[2-(3-methoxyphenoxy)ethyl]-1H-indol-3-yl}-N~1~-[5-(methylsulfonyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-{1-[2-(3-methoxyphenoxy)ethyl]-1H-indol-3-yl}-N~1~-[5-(methylsulfonyl)-1,3,4-thiadiazol-2-yl]acrylamide
2-cyano-3-{1-[2-(3-methoxyphenoxy)ethyl]-1H-indol-3-yl}-N~1~-[5-(methylsulfonyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | C356-0056 |
| Compound Name: | 2-cyano-3-{1-[2-(3-methoxyphenoxy)ethyl]-1H-indol-3-yl}-N~1~-[5-(methylsulfonyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 523.59 |
| Molecular Formula: | C24 H21 N5 O5 S2 |
| Smiles: | COc1cccc(c1)OCCn1cc(/C=C(/C#N)C(Nc2nnc(s2)S(C)(=O)=O)=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.74 |
| logD: | 0.95 |
| logSw: | -4.57 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 234.75 |
| InChI Key: | ANGYGPVIHNJXMI-UHFFFAOYSA-N |