N-[(2-bromo-4-methylphenyl)carbamothioyl]-2-(4-chlorophenyl)quinoline-4-carboxamide
Chemical Structure Depiction of
N-[(2-bromo-4-methylphenyl)carbamothioyl]-2-(4-chlorophenyl)quinoline-4-carboxamide
N-[(2-bromo-4-methylphenyl)carbamothioyl]-2-(4-chlorophenyl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y501-1482 |
| Compound Name: | N-[(2-bromo-4-methylphenyl)carbamothioyl]-2-(4-chlorophenyl)quinoline-4-carboxamide |
| Molecular Weight: | 510.84 |
| Molecular Formula: | C24 H17 Br Cl N3 O S |
| Smiles: | Cc1ccc(c(c1)[Br])NC(NC(c1cc(c2ccc(cc2)[Cl])nc2ccccc12)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 7.5551 |
| logD: | 7.555 |
| logSw: | -6.3272 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.601 |
| InChI Key: | LJMWGZRMTGZADI-UHFFFAOYSA-N |