N-[(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-2-[2-(trifluoromethyl)-6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazol-1-yl]acetamide
Chemical Structure Depiction of
N-[(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-2-[2-(trifluoromethyl)-6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazol-1-yl]acetamide
N-[(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-2-[2-(trifluoromethyl)-6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazol-1-yl]acetamide
Compound characteristics
| Compound ID: | D622-0029 |
| Compound Name: | N-[(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-2-[2-(trifluoromethyl)-6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazol-1-yl]acetamide |
| Molecular Weight: | 463.41 |
| Molecular Formula: | C22 H20 F3 N3 O5 |
| Smiles: | C1COc2ccc(CNC(Cn3c4cc5c(cc4nc3C(F)(F)F)OCCO5)=O)cc2OC1 |
| Stereo: | ACHIRAL |
| logP: | 1.8696 |
| logD: | 1.8696 |
| logSw: | -2.5856 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.616 |
| InChI Key: | QDRGTRJHKDPZEF-UHFFFAOYSA-N |