benzyl {2,2,2-trichloro-1-[(phenylcarbamothioyl)amino]ethyl}carbamate
Chemical Structure Depiction of
benzyl {2,2,2-trichloro-1-[(phenylcarbamothioyl)amino]ethyl}carbamate
benzyl {2,2,2-trichloro-1-[(phenylcarbamothioyl)amino]ethyl}carbamate
Compound characteristics
| Compound ID: | 0515-0016 |
| Compound Name: | benzyl {2,2,2-trichloro-1-[(phenylcarbamothioyl)amino]ethyl}carbamate |
| Molecular Weight: | 432.75 |
| Molecular Formula: | C17 H16 Cl3 N3 O2 S |
| Smiles: | C(c1ccccc1)OC(NC(C([Cl])([Cl])[Cl])NC(Nc1ccccc1)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8658 |
| logD: | 4.6588 |
| logSw: | -4.9707 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 51.816 |
| InChI Key: | KDVUKPVQKAFBHT-AWEZNQCLSA-N |