2-cyano-3-[1-(2-fluorobenzyl)-1H-indol-3-yl]-N~1~-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-[1-(2-fluorobenzyl)-1H-indol-3-yl]-N~1~-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]acrylamide
2-cyano-3-[1-(2-fluorobenzyl)-1H-indol-3-yl]-N~1~-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | 4011-0306 |
| Compound Name: | 2-cyano-3-[1-(2-fluorobenzyl)-1H-indol-3-yl]-N~1~-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 493.56 |
| Molecular Formula: | C28 H20 F N5 O S |
| Smiles: | Cc1ccc(cc1)c1nnc(NC(C(=C/c2cn(Cc3ccccc3F)c3ccccc23)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 6.6 |
| logD: | 6.39 |
| logSw: | -7.28 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 130.37 |
| InChI Key: | IMVCJEJQPQIQHH-UHFFFAOYSA-N |