7-Bromo-1H-quinazolin-4-one

C₈H₅BrN₂OCAS 194851-16-6225.04 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₈H₅BrN₂O
Molar mass: 225.04 g/mol
Exact mass: 223.9585 Da
logP: 1.69Crippen estimate
Polar surface area: 45.8 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Identifiers

CAS number

194851-16-6

SMILES

C1=CC2=C(C=C1Br)N=CNC2=O

InChIKey

FUGKKMYSCAYXJJ-UHFFFAOYSA-N

InChI

InChI=1S/C8H5BrN2O/c9-5-1-2-6-7(3-5)10-4-11-8(6)12/h1-4H,(H,10,11,12)

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Names and synonyms

1 names

7-Bromo-3,4-dihydroquinazolin-4-one

Work with 7-Bromo-1H-quinazolin-4-one

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

7-Bromo-6-chloro-4-quinazolinone17518-98-856 % similar 6-Bromo-1(2H)-isoquinolinone82827-09-651 % similar 6-Bromo-4-quinazolinamine21419-48-749 % similar 6,7-Dimethoxy-3H-quinazolin-4-one13794-72-448 % similar 7-Bromo-1-hydroxyisoquinoline223671-15-647 % similar 6-Bromo-3H-imidazo[4,5-b]pyridine28279-49-444 % similar Thieno(2,3-d)pyrimidin-4(3H)-one14080-50-341 % similar 3H,4H-Thieno[3,2-d]pyrimidin-4-one16234-10-941 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

4-Bromo-1H-pyrrolo[2,3-b]pyridine-3-carboxaldehyde1000340-35-1 6-Bromoquinazolin-4-ol32084-59-6 6-Bromo-2(1H)-quinoxalinone55687-34-8 5-Bromo-1,7-naphthyridin-8(7H)-one67967-14-0

Elsewhere

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