2-methyl-N-(2,2,2-trichloro-1-{[(2-iodophenyl)carbamothioyl]amino}ethyl)benzamide
Chemical Structure Depiction of
2-methyl-N-(2,2,2-trichloro-1-{[(2-iodophenyl)carbamothioyl]amino}ethyl)benzamide
2-methyl-N-(2,2,2-trichloro-1-{[(2-iodophenyl)carbamothioyl]amino}ethyl)benzamide
Compound characteristics
Compound ID: | 0318-0141 |
Compound Name: | 2-methyl-N-(2,2,2-trichloro-1-{[(2-iodophenyl)carbamothioyl]amino}ethyl)benzamide |
Molecular Weight: | 542.65 |
Molecular Formula: | C17 H15 Cl3 I N3 O S |
Smiles: | Cc1ccccc1C(NC(C([Cl])([Cl])[Cl])NC(Nc1ccccc1I)=S)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.254 |
logD: | 3.9814 |
logSw: | -5.605 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 42.662 |
InChI Key: | YAMYFAINACYUJE-HNNXBMFYSA-N |