N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-methyl-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-methyl-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-methyl-6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazol-1-yl)acetamide
Compound characteristics
| Compound ID: | D560-0116 |
| Compound Name: | N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-methyl-6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazol-1-yl)acetamide |
| Molecular Weight: | 395.41 |
| Molecular Formula: | C21 H21 N3 O5 |
| Smiles: | Cc1nc2cc3c(cc2n1CC(Nc1ccc2c(c1)OCCCO2)=O)OCCO3 |
| Stereo: | ACHIRAL |
| logP: | 1.3083 |
| logD: | 1.1344 |
| logSw: | -2.1954 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.071 |
| InChI Key: | QTCSRCZTXADKIZ-UHFFFAOYSA-N |