N-(2-phenylethyl)-2-[2-(trifluoromethyl)-6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazol-1-yl]acetamide
Chemical Structure Depiction of
N-(2-phenylethyl)-2-[2-(trifluoromethyl)-6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazol-1-yl]acetamide
N-(2-phenylethyl)-2-[2-(trifluoromethyl)-6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazol-1-yl]acetamide
Compound characteristics
Compound ID: | D622-0095 |
Compound Name: | N-(2-phenylethyl)-2-[2-(trifluoromethyl)-6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazol-1-yl]acetamide |
Molecular Weight: | 405.37 |
Molecular Formula: | C20 H18 F3 N3 O3 |
Smiles: | C(CNC(Cn1c2cc3c(cc2nc1C(F)(F)F)OCCO3)=O)c1ccccc1 |
Stereo: | ACHIRAL |
logP: | 2.1228 |
logD: | 2.1227 |
logSw: | -2.9422 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 50.303 |
InChI Key: | IUHQXDIIQRYPQT-UHFFFAOYSA-N |