2-cyano-3-[2-methyl-1-(3-methylbenzyl)-1H-indol-3-yl]-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-[2-methyl-1-(3-methylbenzyl)-1H-indol-3-yl]-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
2-cyano-3-[2-methyl-1-(3-methylbenzyl)-1H-indol-3-yl]-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | 4399-0269 |
| Compound Name: | 2-cyano-3-[2-methyl-1-(3-methylbenzyl)-1H-indol-3-yl]-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 481.5 |
| Molecular Formula: | C24 H18 F3 N5 O S |
| Smiles: | Cc1cccc(Cn2c(C)c(/C=C(/C#N)C(Nc3nnc(C(F)(F)F)s3)=O)c3ccccc23)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.26 |
| logD: | 2.02 |
| logSw: | -7.25 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 120.59 |
| InChI Key: | GRKRWVZNROBICQ-UHFFFAOYSA-N |