7-bromo-2,3-dihydro-1H-imidazo[2,1-b]quinazolin-5-one

C10H8BrN3O — CID 136771450

IUPAC7-bromo-2,3-dihydro-1H-imidazo[2,1-b]quinazolin-5-one
SMILESO=c1c2cc(Br)ccc2nc2n1CCN2
InChIInChI=1S/C10H8BrN3O/c11-6-1-2-8-7(5-6)9(15)14-4-3-12-10(14)13-8/h1-2,5H,3-4H2,(H,12,13)
InChIKeyHTSPQYKNGDCXDB-UHFFFAOYSA-N
MW266.10 g/mol
LogP1.58
Rot. Bonds

About 7-bromo-2,3-dihydro-1H-imidazo[2,1-b]quinazolin-5-one

7-bromo-2,3-dihydro-1H-imidazo[2,1-b]quinazolin-5-one (PubChem CID 136771450) has the molecular formula C10H8BrN3O and a molecular weight of 266.10 g/mol. Its IUPAC name is 7-bromo-2,3-dihydro-1H-imidazo[2,1-b]quinazolin-5-one.

Molecular Properties

Compound Name7-bromo-2,3-dihydro-1H-imidazo[2,1-b]quinazolin-5-one
PubChem CID136771450
Molecular FormulaC10H8BrN3O
Molecular Weight266.10 g/mol
Exact Mass264.99
IUPAC Name7-bromo-2,3-dihydro-1H-imidazo[2,1-b]quinazolin-5-one
SMILESO=c1c2cc(Br)ccc2nc2n1CCN2
InChIInChI=1S/C10H8BrN3O/c11-6-1-2-8-7(5-6)9(15)14-4-3-12-10(14)13-8/h1-2,5H,3-4H2,(H,12,13)
InChIKeyHTSPQYKNGDCXDB-UHFFFAOYSA-N
XLogP1.58
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.10
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

8-methyl-1,2,3,4-tetrahydropyrimido[2,1-b]quinazolin-6-one
CID 136826742
[(3R)-7-bromo-9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-3-yl] acetate
CID 927914
3-[bis(4-fluorophenyl)methyl]-6-bromo-2-methylquinazolin-4-one
CID 58187204
8-nitro-3,4-dihydro-1H-pyrimido[2,1-b]quinazoline-2,6-dione
CID 919000
6-bromo-3-ethyl-2-[(1S)-1-[(3S)-3-(hydroxymethyl)piperazin-1-yl]butyl]quinazolin-4-one
CID 156783741
6-bromo-3-ethyl-2-[1-(3-methylpiperazin-1-yl)butyl]quinazolin-4-one
CID 156783667
6-bromo-3-methyl-2-propylsulfanylquinazolin-4-one
CID 2981657
2-amino-6-bromo-3-(cyclopropylmethyl)quinazolin-4-one
CID 67981761
2-bromo-5,6-dihydroisoquinolino[1,2-b]quinazolin-8-one
CID 51360864
2-bromo-8-methylpyrido[2,1-b]quinazolin-11-one
CID 12562121
2,8-dibromoindolo[2,1-b]quinazoline-6,12-dione
CID 4576960
3-[3-[6-bromo-3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanylpropyl]imidazolidine-2,4-dione
CID 55857104

Frequently Asked Questions

What is the IUPAC name of 7-bromo-2,3-dihydro-1H-imidazo[2,1-b]quinazolin-5-one?
The IUPAC name of 7-bromo-2,3-dihydro-1H-imidazo[2,1-b]quinazolin-5-one (CID 136771450) is 7-bromo-2,3-dihydro-1H-imidazo[2,1-b]quinazolin-5-one.
What is the SMILES notation for 7-bromo-2,3-dihydro-1H-imidazo[2,1-b]quinazolin-5-one?
The canonical SMILES for 7-bromo-2,3-dihydro-1H-imidazo[2,1-b]quinazolin-5-one is O=c1c2cc(Br)ccc2nc2n1CCN2.
What is the InChIKey of 7-bromo-2,3-dihydro-1H-imidazo[2,1-b]quinazolin-5-one?
The InChIKey is HTSPQYKNGDCXDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrN3O/c11-6-1-2-8-7(5-6)9(15)14-4-3-12-10(14)13-8/h1-2,5H,3-4H2,(H,12,13).
What are the key properties of 7-bromo-2,3-dihydro-1H-imidazo[2,1-b]quinazolin-5-one?
7-bromo-2,3-dihydro-1H-imidazo[2,1-b]quinazolin-5-one has a molecular weight of 266.10 g/mol, XLogP of 1.58, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-2,3-dihydro-1H-imidazo[2,1-b]quinazolin-5-one is sourced from PubChem (CID 136771450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).