6'-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-5'-cyano-2'-methyl-N-(2-methylphenyl)[3,4'-bipyridine]-3'-carboxamide
Chemical Structure Depiction of
6'-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-5'-cyano-2'-methyl-N-(2-methylphenyl)[3,4'-bipyridine]-3'-carboxamide
6'-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-5'-cyano-2'-methyl-N-(2-methylphenyl)[3,4'-bipyridine]-3'-carboxamide
Compound characteristics
| Compound ID: | 2909-0288 |
| Compound Name: | 6'-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-5'-cyano-2'-methyl-N-(2-methylphenyl)[3,4'-bipyridine]-3'-carboxamide |
| Molecular Weight: | 513.02 |
| Molecular Formula: | C28 H21 Cl N4 O2 S |
| Smiles: | Cc1ccccc1NC(c1c(c2cccnc2)c(C#N)c(nc1C)SCC(c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1303 |
| logD: | 5.1291 |
| logSw: | -5.6932 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.234 |
| InChI Key: | XKZINVCBGAISKV-UHFFFAOYSA-N |