5-cyano-2-methyl-6-({2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}sulfanyl)-N-phenyl-1,4-dihydro[4,4'-bipyridine]-3-carboxamide
Chemical Structure Depiction of
5-cyano-2-methyl-6-({2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}sulfanyl)-N-phenyl-1,4-dihydro[4,4'-bipyridine]-3-carboxamide
5-cyano-2-methyl-6-({2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}sulfanyl)-N-phenyl-1,4-dihydro[4,4'-bipyridine]-3-carboxamide
Compound characteristics
| Compound ID: | 8009-9278 |
| Compound Name: | 5-cyano-2-methyl-6-({2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}sulfanyl)-N-phenyl-1,4-dihydro[4,4'-bipyridine]-3-carboxamide |
| Molecular Weight: | 549.57 |
| Molecular Formula: | C28 H22 F3 N5 O2 S |
| Smiles: | CC1=C(C(C(C#N)=C(N1)SCC(Nc1cccc(c1)C(F)(F)F)=O)c1ccncc1)C(Nc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6091 |
| logD: | 3.8949 |
| logSw: | -4.3786 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.499 |
| InChI Key: | CYZAHBPAWCGUHG-VWLOTQADSA-N |