3-iodo-N-{2,2,2-trichloro-1-[(phenylcarbamothioyl)amino]ethyl}benzamide
Chemical Structure Depiction of
3-iodo-N-{2,2,2-trichloro-1-[(phenylcarbamothioyl)amino]ethyl}benzamide
3-iodo-N-{2,2,2-trichloro-1-[(phenylcarbamothioyl)amino]ethyl}benzamide
Compound characteristics
| Compound ID: | 0602-0093 |
| Compound Name: | 3-iodo-N-{2,2,2-trichloro-1-[(phenylcarbamothioyl)amino]ethyl}benzamide |
| Molecular Weight: | 528.62 |
| Molecular Formula: | C16 H13 Cl3 I N3 O S |
| Smiles: | c1ccc(cc1)NC(NC(C([Cl])([Cl])[Cl])NC(c1cccc(c1)I)=O)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0798 |
| logD: | 3.4603 |
| logSw: | -5.5722 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 43.36 |
| InChI Key: | GWIAJJCYVPFWSG-AWEZNQCLSA-N |