N-[benzyl(phenyl)carbamothioyl]-2-(4-chlorophenyl)quinoline-4-carboxamide
Chemical Structure Depiction of
N-[benzyl(phenyl)carbamothioyl]-2-(4-chlorophenyl)quinoline-4-carboxamide
N-[benzyl(phenyl)carbamothioyl]-2-(4-chlorophenyl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y501-2096 |
| Compound Name: | N-[benzyl(phenyl)carbamothioyl]-2-(4-chlorophenyl)quinoline-4-carboxamide |
| Molecular Weight: | 508.04 |
| Molecular Formula: | C30 H22 Cl N3 O S |
| Smiles: | C(c1ccccc1)N(C(NC(c1cc(c2ccc(cc2)[Cl])nc2ccccc12)=O)=S)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 7.9649 |
| logD: | 7.9649 |
| logSw: | -6.5765 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.077 |
| InChI Key: | HYPOOWZEZHAVBA-UHFFFAOYSA-N |