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Murcko scaffold

1-Benzoyl-1,4-diazepane scaffold

118 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
15
Chemicals
118
With full pages
10
Scaffold SMILES

O=C(c1ccccc1)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-Benzoyl-1,4-diazepane page
Murcko scaffold O=C(c1ccccc1)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 48 of 118 chemicals

1H-1,4-Diazepine, hexahydro-1-(2-((aminoiminomethyl)amino)ethyl)-4-(3,4,5-trimethoxybenzoyl)-,sulfate (2:1) chemical structure, C36H60N10O12S, CAS 99822-49-8
1H-1,4-Diazepine, hexahydro-1-(2-((aminoiminomethyl)amino)ethyl)-4-(3,4,5-trimethoxybenzoyl)-,sulfate (2:1)
CAS 99822-49-8C36H60N10O12S
RefChem:108428 chemical structure, C20H32N2O2, CAS 117009-82-2
RefChem:108428
CAS 117009-82-2C20H32N2O2
(4-Methyl-1,4-diazepan-1-yl)-phenylmethanone chemical structure, C13H18N2O, CAS 727965-54-0
(4-Methyl-1,4-diazepan-1-yl)-phenylmethanone
CAS 727965-54-0C13H18N2O
(4-Bromophenyl)(4-methyl-1,4-diazepan-1-yl)methanone chemical structure, C13H17BrN2O, CAS 898158-79-7
(4-Bromophenyl)(4-methyl-1,4-diazepan-1-yl)methanone
CAS 898158-79-7C13H17BrN2O
(2-Ethoxyphenyl)-(4-methyl-1,4-diazepan-1-yl)methanone chemical structure, C15H22N2O2, CAS 915898-55-4
(2-Ethoxyphenyl)-(4-methyl-1,4-diazepan-1-yl)methanone
CAS 915898-55-4C15H22N2O2
(2-Fluorophenyl)-(4-methyl-1,4-diazepan-1-yl)methanone chemical structure, C13H17FN2O, CAS 886635-76-3
(2-Fluorophenyl)-(4-methyl-1,4-diazepan-1-yl)methanone
CAS 886635-76-3C13H17FN2O
(3-Bromophenyl)-(4-methyl-1,4-diazepan-1-yl)methanone chemical structure, C13H17BrN2O, CAS 915891-52-0
(3-Bromophenyl)-(4-methyl-1,4-diazepan-1-yl)methanone
CAS 915891-52-0C13H17BrN2O
(4-Methyl-1,4-diazepan-1-yl)-(3,4,5-triethoxyphenyl)methanone chemical structure, C19H30N2O4, CAS 898134-06-0
(4-Methyl-1,4-diazepan-1-yl)-(3,4,5-triethoxyphenyl)methanone
CAS 898134-06-0C19H30N2O4
(4-tert-Butylphenyl)-(4-methyl-1,4-diazepan-1-yl)methanone chemical structure, C17H26N2O, CAS 886627-23-2
(4-tert-Butylphenyl)-(4-methyl-1,4-diazepan-1-yl)methanone
CAS 886627-23-2C17H26N2O
(4-Fluorophenyl)-(4-methyl-1,4-diazepan-1-yl)methanone chemical structure, C13H17FN2O, CAS 886635-30-9
(4-Fluorophenyl)-(4-methyl-1,4-diazepan-1-yl)methanone
CAS 886635-30-9C13H17FN2O
1-Benzoyl-1,4-diazepane chemical structure, C12H16N2O, CAS 59939-75-2
1-Benzoyl-1,4-diazepane
CAS 59939-75-2C12H16N2O
1-(3,4,5-Trimethoxybenzoyl)-1,4-diazepane chemical structure, C15H22N2O4, CAS 99822-56-7
1-(3,4,5-Trimethoxybenzoyl)-1,4-diazepane
CAS 99822-56-7C15H22N2O4
1-(4-Methoxybenzoyl)-1,4-diazepane chemical structure, C13H18N2O2, CAS 815650-87-4
1-(4-Methoxybenzoyl)-1,4-diazepane
CAS 815650-87-4C13H18N2O2
1-(3-Fluorobenzoyl)-1,4-diazepane chemical structure, C12H15FN2O, CAS 926215-33-0
1-(3-Fluorobenzoyl)-1,4-diazepane
CAS 926215-33-0C12H15FN2O
1-(2,4-Difluorobenzoyl)-1,4-diazepane chemical structure, C12H14F2N2O, CAS 926199-48-6
1-(2,4-Difluorobenzoyl)-1,4-diazepane
CAS 926199-48-6C12H14F2N2O
1,4-Diazepan-1-yl(2-methylphenyl)methanone chemical structure, C13H18N2O, CAS 815650-72-7
1,4-Diazepan-1-yl(2-methylphenyl)methanone
CAS 815650-72-7C13H18N2O
1-[2-(Trifluoromethyl)benzoyl]-1,4-diazepane chemical structure, C13H15F3N2O, CAS 926193-49-9
1-[2-(Trifluoromethyl)benzoyl]-1,4-diazepane
CAS 926193-49-9C13H15F3N2O
1-(2-Fluorobenzoyl)-1,4-diazepane chemical structure, C12H15FN2O, CAS 926213-29-8
1-(2-Fluorobenzoyl)-1,4-diazepane
CAS 926213-29-8C12H15FN2O
1-(2-Bromobenzoyl)-1,4-diazepane chemical structure, C12H15BrN2O, CAS 815650-74-9
1-(2-Bromobenzoyl)-1,4-diazepane
CAS 815650-74-9C12H15BrN2O
1-(3,5-Dichlorobenzoyl)-1,4-diazepane chemical structure, C12H14Cl2N2O, CAS 926268-06-6
1-(3,5-Dichlorobenzoyl)-1,4-diazepane
CAS 926268-06-6C12H14Cl2N2O
1-(4-Bromobenzoyl)-1,4-diazepane chemical structure, C12H15BrN2O, CAS 926226-47-3
1-(4-Bromobenzoyl)-1,4-diazepane
CAS 926226-47-3C12H15BrN2O
1-(4-Fluorobenzoyl)-1,4-diazepane chemical structure, C12H15FN2O, CAS 203519-36-2
1-(4-Fluorobenzoyl)-1,4-diazepane
CAS 203519-36-2C12H15FN2O
1-(3,4-Dichlorobenzoyl)-1,4-diazepane chemical structure, C12H14Cl2N2O, CAS 926246-21-1
1-(3,4-Dichlorobenzoyl)-1,4-diazepane
CAS 926246-21-1C12H14Cl2N2O
1-(3-Methylbenzoyl)-1,4-diazepane chemical structure, C13H18N2O, CAS 815650-83-0
1-(3-Methylbenzoyl)-1,4-diazepane
CAS 815650-83-0C13H18N2O