2-chlorophenyl 2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}pyridine-3-carboxylate
Chemical Structure Depiction of
2-chlorophenyl 2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}pyridine-3-carboxylate
2-chlorophenyl 2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}pyridine-3-carboxylate
Compound characteristics
Compound ID: | K786-3103 |
Compound Name: | 2-chlorophenyl 2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}pyridine-3-carboxylate |
Molecular Weight: | 433.31 |
Molecular Formula: | C20 H14 Cl2 N2 O3 S |
Smiles: | C(C(Nc1ccccc1[Cl])=O)Sc1c(cccn1)C(=O)Oc1ccccc1[Cl] |
Stereo: | ACHIRAL |
logP: | 4.3895 |
logD: | 4.3893 |
logSw: | -4.5797 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 52.062 |
InChI Key: | QFQLGEWCJBGBQM-UHFFFAOYSA-N |