7,8-dimethoxy-4H-imidazo[1,2-a]quinazolin-5-one

C12H11N3O3 — CID 166476403

IUPAC7,8-dimethoxy-4H-imidazo[1,2-a]quinazolin-5-one
SMILESCOc1cc2c(=O)[nH]c3nccn3c2cc1OC
InChIInChI=1S/C12H11N3O3/c1-17-9-5-7-8(6-10(9)18-2)15-4-3-13-12(15)14-11(7)16/h3-6H,1-2H3,(H,13,14,16)
InChIKeyMOEVKUZSDVSLHT-UHFFFAOYSA-N
MW245.24 g/mol
LogP1.19
Rot. Bonds2

About 7,8-dimethoxy-4H-imidazo[1,2-a]quinazolin-5-one

7,8-dimethoxy-4H-imidazo[1,2-a]quinazolin-5-one (PubChem CID 166476403) has the molecular formula C12H11N3O3 and a molecular weight of 245.24 g/mol. Its IUPAC name is 7,8-dimethoxy-4H-imidazo[1,2-a]quinazolin-5-one.

Molecular Properties

Compound Name7,8-dimethoxy-4H-imidazo[1,2-a]quinazolin-5-one
PubChem CID166476403
Molecular FormulaC12H11N3O3
Molecular Weight245.24 g/mol
Exact Mass245.08
IUPAC Name7,8-dimethoxy-4H-imidazo[1,2-a]quinazolin-5-one
SMILESCOc1cc2c(=O)[nH]c3nccn3c2cc1OC
InChIInChI=1S/C12H11N3O3/c1-17-9-5-7-8(6-10(9)18-2)15-4-3-13-12(15)14-11(7)16/h3-6H,1-2H3,(H,13,14,16)
InChIKeyMOEVKUZSDVSLHT-UHFFFAOYSA-N
XLogP1.19
TPSA68.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.24
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1,3,4,8,10-pentazatricyclo[7.3.0.02,6]dodeca-2(6),4,9,11-tetraen-7-one
CID 68635672
6,7-dimethoxy-1-(2-trimethylsilylethoxymethyl)quinazoline-2,4-dione
CID 18753664
6,7-dimethoxy-2-[(2-propan-2-ylimidazol-1-yl)methyl]-3H-quinazolin-4-one
CID 137031235
1-hydroxy-6,7-dimethoxyquinazolin-4-one
CID 141109188
2-bromo-6,7-dimethoxy-3H-quinazolin-4-one
CID 163409774
6,7-dimethoxy-1H-quinazoline-2,4-dione;hydrochloride
CID 139789848
7,8-dimethoxy-5H-imidazo[1,5-a]quinoxalin-4-one
CID 11776619
7,8-dimethoxy-5-oxo-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
CID 50761958
4,5-dimethoxy-15-methyl-9,11,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,12,14,16-heptaen-8-one
CID 141184930
4,5,15,16-tetramethoxy-1,11-diazapentacyclo[10.7.1.02,7.08,20.013,18]icosa-2,4,6,8(20),9,11,13,15,17-nonaen-19-one
CID 134505202
8,9-dimethoxy-5H-phenanthridin-6-one
CID 12703535
2-[[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-6,7-dimethoxy-3H-quinazolin-4-one
CID 135858474

Frequently Asked Questions

What is the IUPAC name of 7,8-dimethoxy-4H-imidazo[1,2-a]quinazolin-5-one?
The IUPAC name of 7,8-dimethoxy-4H-imidazo[1,2-a]quinazolin-5-one (CID 166476403) is 7,8-dimethoxy-4H-imidazo[1,2-a]quinazolin-5-one.
What is the SMILES notation for 7,8-dimethoxy-4H-imidazo[1,2-a]quinazolin-5-one?
The canonical SMILES for 7,8-dimethoxy-4H-imidazo[1,2-a]quinazolin-5-one is COc1cc2c(=O)[nH]c3nccn3c2cc1OC.
What is the InChIKey of 7,8-dimethoxy-4H-imidazo[1,2-a]quinazolin-5-one?
The InChIKey is MOEVKUZSDVSLHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O3/c1-17-9-5-7-8(6-10(9)18-2)15-4-3-13-12(15)14-11(7)16/h3-6H,1-2H3,(H,13,14,16).
What are the key properties of 7,8-dimethoxy-4H-imidazo[1,2-a]quinazolin-5-one?
7,8-dimethoxy-4H-imidazo[1,2-a]quinazolin-5-one has a molecular weight of 245.24 g/mol, XLogP of 1.19, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-dimethoxy-4H-imidazo[1,2-a]quinazolin-5-one is sourced from PubChem (CID 166476403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).