2-[(2-chlorophenyl)sulfanyl]-N-[(4-fluorophenyl)methyl]quinoline-4-carboxamide
Chemical Structure Depiction of
2-[(2-chlorophenyl)sulfanyl]-N-[(4-fluorophenyl)methyl]quinoline-4-carboxamide
2-[(2-chlorophenyl)sulfanyl]-N-[(4-fluorophenyl)methyl]quinoline-4-carboxamide
Compound characteristics
Compound ID: | C072-0033 |
Compound Name: | 2-[(2-chlorophenyl)sulfanyl]-N-[(4-fluorophenyl)methyl]quinoline-4-carboxamide |
Molecular Weight: | 422.91 |
Molecular Formula: | C23 H16 Cl F N2 O S |
Smiles: | C(c1ccc(cc1)F)NC(c1cc(nc2ccccc12)Sc1ccccc1[Cl])=O |
Stereo: | ACHIRAL |
logP: | 6.0305 |
logD: | 6.0305 |
logSw: | -6.1745 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 32.072 |
InChI Key: | BGHOVWJGQYCOSM-UHFFFAOYSA-N |