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Murcko scaffold

1,4-Diazepan-5-one scaffold

111 chemicals on CompoundList share this ring system.

Rings
1
Scaffold atoms
8
Chemicals
111
With full pages
18
Scaffold SMILES

O=C1CCNCCN1

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 1,4-Diazepan-5-one page
Murcko scaffold O=C1CCNCCN1

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 111 chemicals

1-Methyl-1,4-diazepan-5-one chemical structure, C6H12N2O, CAS 5441-40-7
1-Methyl-1,4-diazepan-5-one
CAS 5441-40-7C6H12N2O
2,2,7,7-Tetramethyl-1,4-diazepan-5-one chemical structure, C9H18N2O, CAS 34392-00-2
2,2,7,7-Tetramethyl-1,4-diazepan-5-one
CAS 34392-00-2C9H18N2O
1,4-Diazepan-5-one chemical structure, C5H10N2O, CAS 34376-54-0
1,4-Diazepan-5-one
CAS 34376-54-0C5H10N2O
4-Oxo-4-(5-oxo-1,4-diazepan-1-yl)butanoic acid chemical structure, C9H14N2O4, CAS 397244-77-8
4-Oxo-4-(5-oxo-1,4-diazepan-1-yl)butanoic acid
CAS 397244-77-8C9H14N2O4
Methyl 3-(5-oxo-1,4-diazepan-1-yl)propanoate chemical structure, C9H16N2O3, CAS 397244-78-9
Methyl 3-(5-oxo-1,4-diazepan-1-yl)propanoate
CAS 397244-78-9C9H16N2O3
4-(2-(Dimethylamino)ethyl)-1,4-diazepan-5-one chemical structure, C9H19N3O, CAS 344779-07-3
4-(2-(Dimethylamino)ethyl)-1,4-diazepan-5-one
CAS 344779-07-3C9H19N3O
1-Isopropyl-[1,4]diazepan-5-one chemical structure, C8H16N2O, CAS 59039-85-9
1-Isopropyl-[1,4]diazepan-5-one
CAS 59039-85-9C8H16N2O
Ethyl 5-oxo-1,4-diazepane-1-carboxylate chemical structure, C8H14N2O3, CAS 119844-70-1
Ethyl 5-oxo-1,4-diazepane-1-carboxylate
CAS 119844-70-1C8H14N2O3
1,4-Diazepan-5-one, acetic acid chemical structure, C7H14N2O3, CAS 190900-20-0
1,4-Diazepan-5-one, acetic acid
CAS 190900-20-0C7H14N2O3
4-Methyl-1,4-diazepan-5-one hydrochloride chemical structure, C6H13ClN2O, CAS 329794-41-4
4-Methyl-1,4-diazepan-5-one hydrochloride
CAS 329794-41-4C6H13ClN2O
4-Methyl-1,4-diazepan-5-one chemical structure, C6H12N2O, CAS 172314-56-6
4-Methyl-1,4-diazepan-5-one
CAS 172314-56-6C6H12N2O
1,4-Dimethyl-1,4-diazepan-5-one chemical structure, C7H14N2O, CAS 65675-38-9
1,4-Dimethyl-1,4-diazepan-5-one
CAS 65675-38-9C7H14N2O
1-Ethyl-1,4-diazepan-5-one chemical structure, C7H14N2O, CAS 3619-70-3
1-Ethyl-1,4-diazepan-5-one
CAS 3619-70-3C7H14N2O
1-tert-Butyl-1,4-diazepan-5-one chemical structure, C9H18N2O, CAS 55186-87-3
1-tert-Butyl-1,4-diazepan-5-one
CAS 55186-87-3C9H18N2O
Ethyl 2-(7-oxo-1,4-diazepan-1-yl)acetate chemical structure, C9H16N2O3, CAS 214911-31-6
Ethyl 2-(7-oxo-1,4-diazepan-1-yl)acetate
CAS 214911-31-6C9H16N2O3
5-Oxo-(1,4)diazepane-1-carboxylic acid tert-butyl ester chemical structure, C10H18N2O3, CAS 190900-21-1
5-Oxo-(1,4)diazepane-1-carboxylic acid tert-butyl ester
CAS 190900-21-1C10H18N2O3
1,4-Diazepan-5-one hydrochloride chemical structure, C5H11ClN2O, CAS 208245-76-5
1,4-Diazepan-5-one hydrochloride
CAS 208245-76-5C5H11ClN2O
1-Butyl-1,4-diazepan-5-one chemical structure, C9H18N2O, CAS 3619-72-5
1-Butyl-1,4-diazepan-5-one
CAS 3619-72-5C9H18N2O
1,1-Dimethyl-5-oxo-1,4-diazepan-1-ium iodide chemical structure, C7H15IN2O, CAS 935-25-1
1,1-Dimethyl-5-oxo-1,4-diazepan-1-ium iodide
CAS 935-25-1C7H15IN2O
Ethyl (2-ethyl-5-oxo-1,4-diazepan-1-yl)acetate chemical structure, C11H20N2O3, CAS 1142198-02-4
Ethyl (2-ethyl-5-oxo-1,4-diazepan-1-yl)acetate
CAS 1142198-02-4C11H20N2O3
(2S)-2-Methyl-1,4-diazepan-5-one chemical structure, C6H12N2O, CAS 2740525-30-6
(2S)-2-Methyl-1,4-diazepan-5-one
CAS 2740525-30-6C6H12N2O
[(Hexahydro-2,2,7,7-tetramethyl-5-oxo-1H-1,4-diazepine-1-yl)oxy]radical chemical structure, C9H17N2O2, CAS 41578-59-0
[(Hexahydro-2,2,7,7-tetramethyl-5-oxo-1H-1,4-diazepine-1-yl)oxy]radical
CAS 41578-59-0C9H17N2O2
Hexahydro-7-methyl-5H-1,4-diazepin-5-one chemical structure, C6H12N2O, CAS 90673-37-3
Hexahydro-7-methyl-5H-1,4-diazepin-5-one
CAS 90673-37-3C6H12N2O
2-Methyl-1,4-diazepan-5-one chemical structure, C6H12N2O, CAS 1177348-65-0
2-Methyl-1,4-diazepan-5-one
CAS 1177348-65-0C6H12N2O