N-[(8-methyl-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-[(8-methyl-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-[(8-methyl-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: | D622-0030 |
| Compound Name: | N-[(8-methyl-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: | 477.44 |
| Molecular Formula: | C23 H22 F3 N3 O5 |
| Smiles: | Cc1cc2c(cc1CNC(Cn1c3cc4c(cc3nc1C(F)(F)F)OCCO4)=O)OCCCO2 |
| Stereo: | ACHIRAL |
| logP: | 2.189 |
| logD: | 2.1889 |
| logSw: | -2.4793 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.616 |
| InChI Key: | BMCAMMQVILUNCT-UHFFFAOYSA-N |