2-cyano-3-[1-(4-fluorobenzyl)-2-methyl-1H-indol-3-yl]-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-[1-(4-fluorobenzyl)-2-methyl-1H-indol-3-yl]-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
2-cyano-3-[1-(4-fluorobenzyl)-2-methyl-1H-indol-3-yl]-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | 8013-0620 |
| Compound Name: | 2-cyano-3-[1-(4-fluorobenzyl)-2-methyl-1H-indol-3-yl]-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 485.46 |
| Molecular Formula: | C23 H15 F4 N5 O S |
| Smiles: | Cc1c(/C=C(/C#N)C(Nc2nnc(C(F)(F)F)s2)=O)c2ccccc2n1Cc1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 5.64 |
| logD: | 1.4 |
| logSw: | -6.6 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 126.78 |
| InChI Key: | PQVHLRHDYKRJLN-UHFFFAOYSA-N |