3-iodo-N-(2,2,2-trichloro-1-{[(4-iodophenyl)carbamothioyl]amino}ethyl)benzamide
Chemical Structure Depiction of
3-iodo-N-(2,2,2-trichloro-1-{[(4-iodophenyl)carbamothioyl]amino}ethyl)benzamide
3-iodo-N-(2,2,2-trichloro-1-{[(4-iodophenyl)carbamothioyl]amino}ethyl)benzamide
Compound characteristics
| Compound ID: | 0602-0110 |
| Compound Name: | 3-iodo-N-(2,2,2-trichloro-1-{[(4-iodophenyl)carbamothioyl]amino}ethyl)benzamide |
| Molecular Weight: | 654.52 |
| Molecular Formula: | C16 H12 Cl3 I2 N3 O S |
| Smiles: | c1cc(cc(c1)I)C(NC(C([Cl])([Cl])[Cl])NC(Nc1ccc(cc1)I)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.4821 |
| logD: | 4.8627 |
| logSw: | -6.6437 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 43.36 |
| InChI Key: | SQOVTFHBSUSOAM-AWEZNQCLSA-N |