ethyl 5-cyano-4-(2-fluorophenyl)-6-[(2-methoxy-2-oxoethyl)sulfanyl]-2-phenyl-1,4-dihydropyridine-3-carboxylate
Chemical Structure Depiction of
ethyl 5-cyano-4-(2-fluorophenyl)-6-[(2-methoxy-2-oxoethyl)sulfanyl]-2-phenyl-1,4-dihydropyridine-3-carboxylate
ethyl 5-cyano-4-(2-fluorophenyl)-6-[(2-methoxy-2-oxoethyl)sulfanyl]-2-phenyl-1,4-dihydropyridine-3-carboxylate
Compound characteristics
Compound ID: | D360-2344 |
Compound Name: | ethyl 5-cyano-4-(2-fluorophenyl)-6-[(2-methoxy-2-oxoethyl)sulfanyl]-2-phenyl-1,4-dihydropyridine-3-carboxylate |
Molecular Weight: | 452.5 |
Molecular Formula: | C24 H21 F N2 O4 S |
Smiles: | CCOC(C1C(C(C#N)=C(NC=1c1ccccc1)SCC(=O)OC)c1ccccc1F)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.5144 |
logD: | 0.171 |
logSw: | -4.1563 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 68.664 |
InChI Key: | IFEJCNIRTFTORV-FQEVSTJZSA-N |