N-(4-chlorophenyl)-5-cyano-6-{[2-(4-iodoanilino)-2-oxoethyl]sulfanyl}-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-5-cyano-6-{[2-(4-iodoanilino)-2-oxoethyl]sulfanyl}-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide
N-(4-chlorophenyl)-5-cyano-6-{[2-(4-iodoanilino)-2-oxoethyl]sulfanyl}-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide
Compound characteristics
| Compound ID: | 8011-7436 |
| Compound Name: | N-(4-chlorophenyl)-5-cyano-6-{[2-(4-iodoanilino)-2-oxoethyl]sulfanyl}-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide |
| Molecular Weight: | 640.93 |
| Molecular Formula: | C28 H22 Cl I N4 O2 S |
| Smiles: | CC1=C(C(C(C#N)=C(N1)SCC(Nc1ccc(cc1)I)=O)c1ccccc1)C(Nc1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7249 |
| logD: | 6.0108 |
| logSw: | -6.4726 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 73.071 |
| InChI Key: | XXNPJVTWQDXRBF-SANMLTNESA-N |