N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(trifluoromethyl)-1H-benzimidazol-7-amine--hydrogen chloride (1/2)
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(trifluoromethyl)-1H-benzimidazol-7-amine--hydrogen chloride (1/2)
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(trifluoromethyl)-1H-benzimidazol-7-amine--hydrogen chloride (1/2)
Compound characteristics
| Compound ID: | 8017-8463 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(trifluoromethyl)-1H-benzimidazol-7-amine--hydrogen chloride (1/2) |
| Molecular Weight: | 408.2 |
| Molecular Formula: | C16 H12 F3 N3 O2 |
| Salt: | 2HCl |
| Smiles: | C(c1ccc2c(c1)OCO2)Nc1cccc2c1[nH]c(C(F)(F)F)n2 |
| Stereo: | ACHIRAL |
| logP: | 3.3587 |
| logD: | 3.0121 |
| logSw: | -3.5248 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.952 |
| InChI Key: | NXLQDYZSCHAZPV-UHFFFAOYSA-N |