ethyl 5'-cyano-6'-(ethylsulfanyl)-2'-phenyl-1',4'-dihydro[3,4'-bipyridine]-3'-carboxylate
Chemical Structure Depiction of
ethyl 5'-cyano-6'-(ethylsulfanyl)-2'-phenyl-1',4'-dihydro[3,4'-bipyridine]-3'-carboxylate
ethyl 5'-cyano-6'-(ethylsulfanyl)-2'-phenyl-1',4'-dihydro[3,4'-bipyridine]-3'-carboxylate
Compound characteristics
| Compound ID: | 8012-5289 |
| Compound Name: | ethyl 5'-cyano-6'-(ethylsulfanyl)-2'-phenyl-1',4'-dihydro[3,4'-bipyridine]-3'-carboxylate |
| Molecular Weight: | 391.49 |
| Molecular Formula: | C22 H21 N3 O2 S |
| Smiles: | CCOC(C1C(C(C#N)=C(NC=1c1ccccc1)SCC)c1cccnc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0711 |
| logD: | -0.3306 |
| logSw: | -3.6814 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.603 |
| InChI Key: | FXKRUHFBWXBHRN-SFHVURJKSA-N |