3-methyl-N-(2,2,2-trichloro-1-{[(2,4-dimethylphenyl)carbamothioyl]amino}ethyl)benzamide
Chemical Structure Depiction of
3-methyl-N-(2,2,2-trichloro-1-{[(2,4-dimethylphenyl)carbamothioyl]amino}ethyl)benzamide
3-methyl-N-(2,2,2-trichloro-1-{[(2,4-dimethylphenyl)carbamothioyl]amino}ethyl)benzamide
Compound characteristics
Compound ID: | 1501-0349 |
Compound Name: | 3-methyl-N-(2,2,2-trichloro-1-{[(2,4-dimethylphenyl)carbamothioyl]amino}ethyl)benzamide |
Molecular Weight: | 444.81 |
Molecular Formula: | C19 H20 Cl3 N3 O S |
Smiles: | Cc1cccc(c1)C(NC(C([Cl])([Cl])[Cl])NC(Nc1ccc(C)cc1C)=S)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.255 |
logD: | 3.9827 |
logSw: | -5.8756 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 42.662 |
InChI Key: | YIHQJNZPBXHQLN-KRWDZBQOSA-N |