N-[1-(tert-butylamino)-2,2,2-trichloroethylidene]-4-methylbenzamide
Chemical Structure Depiction of
N-[1-(tert-butylamino)-2,2,2-trichloroethylidene]-4-methylbenzamide
N-[1-(tert-butylamino)-2,2,2-trichloroethylidene]-4-methylbenzamide
Compound characteristics
| Compound ID: | 0131-0006 |
| Compound Name: | N-[1-(tert-butylamino)-2,2,2-trichloroethylidene]-4-methylbenzamide |
| Molecular Weight: | 335.66 |
| Molecular Formula: | C14 H17 Cl3 N2 O |
| Smiles: | Cc1ccc(cc1)C(/N=C(\C([Cl])([Cl])[Cl])NC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1604 |
| logD: | 3.1402 |
| logSw: | -4.406 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.076 |
| InChI Key: | KUBXTZZZABPUQQ-UHFFFAOYSA-N |