2,2-diphenyl-N-(2,2,2-trichloro-1-{[(3-nitrophenyl)carbamothioyl]amino}ethyl)acetamide
Chemical Structure Depiction of
2,2-diphenyl-N-(2,2,2-trichloro-1-{[(3-nitrophenyl)carbamothioyl]amino}ethyl)acetamide
2,2-diphenyl-N-(2,2,2-trichloro-1-{[(3-nitrophenyl)carbamothioyl]amino}ethyl)acetamide
Compound characteristics
| Compound ID: | 0502-0023 |
| Compound Name: | 2,2-diphenyl-N-(2,2,2-trichloro-1-{[(3-nitrophenyl)carbamothioyl]amino}ethyl)acetamide |
| Molecular Weight: | 537.85 |
| Molecular Formula: | C23 H19 Cl3 N4 O3 S |
| Smiles: | c1ccc(cc1)C(C(NC(C([Cl])([Cl])[Cl])NC(Nc1cccc(c1)[N+]([O-])=O)=S)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9628 |
| logD: | 5.1838 |
| logSw: | -6.3811 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 76.47 |
| InChI Key: | SGBFDNVYDSFQLE-NRFANRHFSA-N |