5-cyano-6-{[2-(diethylamino)-2-oxoethyl]sulfanyl}-4-(2-fluorophenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Chemical Structure Depiction of
5-cyano-6-{[2-(diethylamino)-2-oxoethyl]sulfanyl}-4-(2-fluorophenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
5-cyano-6-{[2-(diethylamino)-2-oxoethyl]sulfanyl}-4-(2-fluorophenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Compound characteristics
| Compound ID: | 5543-0009 |
| Compound Name: | 5-cyano-6-{[2-(diethylamino)-2-oxoethyl]sulfanyl}-4-(2-fluorophenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide |
| Molecular Weight: | 478.59 |
| Molecular Formula: | C26 H27 F N4 O2 S |
| Smiles: | CCN(CC)C(CSC1=C(C#N)C(C(=C(C)N1)C(Nc1ccccc1)=O)c1ccccc1F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1717 |
| logD: | 3.5841 |
| logSw: | -4.0153 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.598 |
| InChI Key: | IPMCLEOGBRHDFJ-DEOSSOPVSA-N |