3-chloro-N-(2,2,2-trichloro-1-{[(4-sulfamoylphenyl)carbamothioyl]amino}ethyl)benzamide
Chemical Structure Depiction of
3-chloro-N-(2,2,2-trichloro-1-{[(4-sulfamoylphenyl)carbamothioyl]amino}ethyl)benzamide
3-chloro-N-(2,2,2-trichloro-1-{[(4-sulfamoylphenyl)carbamothioyl]amino}ethyl)benzamide
Compound characteristics
| Compound ID: | 1309-0552 |
| Compound Name: | 3-chloro-N-(2,2,2-trichloro-1-{[(4-sulfamoylphenyl)carbamothioyl]amino}ethyl)benzamide |
| Molecular Weight: | 516.25 |
| Molecular Formula: | C16 H14 Cl4 N4 O3 S2 |
| Smiles: | c1cc(cc(c1)[Cl])C(NC(C([Cl])([Cl])[Cl])NC(Nc1ccc(cc1)S(N)(=O)=O)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1834 |
| logD: | 1.564 |
| logSw: | -3.6933 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 5 |
| Polar surface area: | 93.963 |
| InChI Key: | KKZQVFVURNYQTL-AWEZNQCLSA-N |