N-{2,2,2-trichloro-1-[({2-methyl-4-[(2-methylphenyl)diazenyl]phenyl}carbamothioyl)amino]ethyl}acetamide
Chemical Structure Depiction of
N-{2,2,2-trichloro-1-[({2-methyl-4-[(2-methylphenyl)diazenyl]phenyl}carbamothioyl)amino]ethyl}acetamide
N-{2,2,2-trichloro-1-[({2-methyl-4-[(2-methylphenyl)diazenyl]phenyl}carbamothioyl)amino]ethyl}acetamide
Compound characteristics
| Compound ID: | 1501-0115 |
| Compound Name: | N-{2,2,2-trichloro-1-[({2-methyl-4-[(2-methylphenyl)diazenyl]phenyl}carbamothioyl)amino]ethyl}acetamide |
| Molecular Weight: | 472.82 |
| Molecular Formula: | C19 H20 Cl3 N5 O S |
| Smiles: | CC(NC(C([Cl])([Cl])[Cl])NC(Nc1ccc(cc1C)/N=N/c1ccccc1C)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3001 |
| logD: | 5.2631 |
| logSw: | -5.7989 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 63.822 |
| InChI Key: | VCYRUPBRKOLUJP-KRWDZBQOSA-N |