N'-[(3-nitrobenzoyl)oxy][2-(trifluoromethyl)-1H-benzimidazol-1-yl]ethanimidamide
Chemical Structure Depiction of
N'-[(3-nitrobenzoyl)oxy][2-(trifluoromethyl)-1H-benzimidazol-1-yl]ethanimidamide
N'-[(3-nitrobenzoyl)oxy][2-(trifluoromethyl)-1H-benzimidazol-1-yl]ethanimidamide
Compound characteristics
| Compound ID: | Y501-1822 |
| Compound Name: | N'-[(3-nitrobenzoyl)oxy][2-(trifluoromethyl)-1H-benzimidazol-1-yl]ethanimidamide |
| Molecular Weight: | 407.31 |
| Molecular Formula: | C17 H12 F3 N5 O4 |
| Smiles: | C(/C(N)=N/OC(c1cccc(c1)[N+]([O-])=O)=O)n1c2ccccc2nc1C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 3.1554 |
| logD: | 3.1554 |
| logSw: | -3.4042 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.593 |
| InChI Key: | BYISVGAAZMSPHZ-UHFFFAOYSA-N |