N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-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)-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)-2-[2-(trifluoromethyl)-6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazol-1-yl]acetamide
Compound characteristics
| Compound ID: | D622-0031 |
| Compound Name: | N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[2-(trifluoromethyl)-6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazol-1-yl]acetamide |
| Molecular Weight: | 449.38 |
| Molecular Formula: | C21 H18 F3 N3 O5 |
| Smiles: | C1COc2ccc(cc2OC1)NC(Cn1c2cc3c(cc2nc1C(F)(F)F)OCCO3)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2119 |
| logD: | 2.2118 |
| logSw: | -2.9983 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.294 |
| InChI Key: | NMVAYIVSGVJLTL-UHFFFAOYSA-N |