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Murcko scaffold

1-(Hexahydro-1H-1,4-diazepin-1-yl)-2-phenoxyethanone scaffold

17 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
17
Chemicals
17
With full pages
4
Scaffold SMILES

O=C(COc1ccccc1)N1CCCNCC1

A Bemis-Murcko scaffold is what remains of a molecule when every side chain is removed: the rings and the chains that link them. Chemicals that share a scaffold often belong to the same compound series, which helps when you look for analogues, alternative suppliers or related building blocks.

Substructure search with this scaffoldOpen the 1-(Hexahydro-1H-1,4-diazepin-1-yl)-2-phenoxyethanone page
Murcko scaffold O=C(COc1ccccc1)N1CCCNCC1

Computed from the structures of the chemicals listed here. Stereo and charges are removed before the scaffold is taken.

Chemicals with this scaffold

Open one to see its structure, properties and suppliers.

Showing 1 to 17 of 17 chemicals

2-(4-Chlorophenoxy)-1-(4-methyl-1,4-diazepan-1-yl)ethanone chemical structure, C14H19ClN2O2, CAS 915900-52-6
2-(4-Chlorophenoxy)-1-(4-methyl-1,4-diazepan-1-yl)ethanone
CAS 915900-52-6C14H19ClN2O2
2-(4-Chloro-2-methylphenoxy)-1-(4-methyl-1,4-diazepan-1-yl)ethanone chemical structure, C15H21ClN2O2, CAS 915903-56-9
2-(4-Chloro-2-methylphenoxy)-1-(4-methyl-1,4-diazepan-1-yl)ethanone
CAS 915903-56-9C15H21ClN2O2
2-(4-Bromophenoxy)-1-(4-methyl-1,4-diazepan-1-yl)ethanone chemical structure, C14H19BrN2O2, CAS 915900-74-2
2-(4-Bromophenoxy)-1-(4-methyl-1,4-diazepan-1-yl)ethanone
CAS 915900-74-2C14H19BrN2O2
1-(4-Methyl-1,4-diazepan-1-yl)-2-[4-(propan-2-yl)phenoxy]ethanone chemical structure, C17H26N2O2, CAS 915880-22-7
1-(4-Methyl-1,4-diazepan-1-yl)-2-[4-(propan-2-yl)phenoxy]ethanone
CAS 915880-22-7C17H26N2O2
1-(4-Methyl-1,4-diazepan-1-yl)-2-[3-(trifluoromethyl)phenoxy]ethanone chemical structure, C15H19F3N2O2, CAS 915919-15-2
1-(4-Methyl-1,4-diazepan-1-yl)-2-[3-(trifluoromethyl)phenoxy]ethanone
CAS 915919-15-2C15H19F3N2O2
2-(2-Chlorophenoxy)-1-(4-methyl-1,4-diazepan-1-yl)ethan-1-one chemical structure, C14H19ClN2O2, CAS 925621-65-4
2-(2-Chlorophenoxy)-1-(4-methyl-1,4-diazepan-1-yl)ethan-1-one
CAS 925621-65-4C14H19ClN2O2
2-(4-Chlorophenoxy)-1-(1,4-diazepan-1-yl)ethan-1-one chemical structure, C13H17ClN2O2, CAS 815650-88-5
2-(4-Chlorophenoxy)-1-(1,4-diazepan-1-yl)ethan-1-one
CAS 815650-88-5C13H17ClN2O2
1-(Hexahydro-1H-1,4-diazepin-1-yl)-2-phenoxyethanone chemical structure, C13H18N2O2, CAS 815650-85-2
1-(Hexahydro-1H-1,4-diazepin-1-yl)-2-phenoxyethanone
CAS 815650-85-2C13H18N2O2
1-(1,4-Diazepan-1-yl)-2-(2,4-dichlorophenoxy)ethan-1-one chemical structure, C13H16Cl2N2O2, CAS 815650-86-3
1-(1,4-Diazepan-1-yl)-2-(2,4-dichlorophenoxy)ethan-1-one
CAS 815650-86-3C13H16Cl2N2O2
1-(Hexahydro-1H-1,4-diazepin-1-yl)-2-phenoxy-1-propanone chemical structure, C14H20N2O2, CAS 815651-31-1
1-(Hexahydro-1H-1,4-diazepin-1-yl)-2-phenoxy-1-propanone
CAS 815651-31-1C14H20N2O2
1-(1,4-Diazepan-1-yl)-2-(2,4-dimethylphenoxy)ethan-1-one chemical structure, C15H22N2O2, CAS 815650-73-8
1-(1,4-Diazepan-1-yl)-2-(2,4-dimethylphenoxy)ethan-1-one
CAS 815650-73-8C15H22N2O2
2-(4-Bromophenoxy)-1-(hexahydro-1H-1,4-diazepin-1-yl)ethanone chemical structure, C13H17BrN2O2, CAS 815651-07-1
2-(4-Bromophenoxy)-1-(hexahydro-1H-1,4-diazepin-1-yl)ethanone
CAS 815651-07-1C13H17BrN2O2
2-(2,4-Dichlorophenoxy)-1-(hexahydro-1H-1,4-diazepin-1-yl)-1-propanone chemical structure, C14H18Cl2N2O2, CAS 815650-99-8
2-(2,4-Dichlorophenoxy)-1-(hexahydro-1H-1,4-diazepin-1-yl)-1-propanone
CAS 815650-99-8C14H18Cl2N2O2
2-(2-tert-Butylphenoxy)-1-(1,4-diazepan-1-yl)ethan-1-one chemical structure, C17H26N2O2, CAS 1225727-10-5
2-(2-tert-Butylphenoxy)-1-(1,4-diazepan-1-yl)ethan-1-one
CAS 1225727-10-5C17H26N2O2
1-(1,4-Diazepan-1-yl)-2-(m-tolyloxy)ethan-1-one hydrochloride chemical structure, C14H21ClN2O2, CAS 1572197-25-1
1-(1,4-Diazepan-1-yl)-2-(m-tolyloxy)ethan-1-one hydrochloride
CAS 1572197-25-1C14H21ClN2O2
1-[4-(2-Phenoxyacetyl)-1,4-diazepan-1-yl]prop-2-en-1-one chemical structure, C16H20N2O3, CAS 2196076-63-6
1-[4-(2-Phenoxyacetyl)-1,4-diazepan-1-yl]prop-2-en-1-one
CAS 2196076-63-6C16H20N2O3
4-(2-Phenoxyacetyl)-1,4-diazepane-1-sulfonyl fluoride chemical structure, C13H17FN2O4S, CAS 2411300-43-9
4-(2-Phenoxyacetyl)-1,4-diazepane-1-sulfonyl fluoride
CAS 2411300-43-9C13H17FN2O4S