6-Acetoxy-7-methoxy-3H-quinazolin-4-one

C11H10N2O4CAS 179688-53-0234.21 g/mol

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OOONHNO
EsterEther

Properties

Molecular formula
C11H10N2O4
Molar mass
234.21 g/mol
Exact mass
234.0641 Da
logP
0.86Crippen estimate
Polar surface area
81.3 Ų
H-bond donors / acceptors
1 / 5
Rotatable bonds
2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
179688-53-0
SMILES
CC(=O)OC1=C(C=C2C(=C1)C(=O)NC=N2)OC
InChIKey
SOLQIFINSOHAQD-UHFFFAOYSA-N
InChI
InChI=1S/C11H10N2O4/c1-6(14)17-10-3-7-8(4-9(10)16-2)12-5-13-11(7)15/h3-5H,1-2H3,(H,12,13,15)

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Names and synonyms

1 names
  • 3,4-Dihydro-7-methoxy-4-oxoquinazolin-6-yl acetate

Work with 6-Acetoxy-7-methoxy-3H-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

6,7-Dimethoxy-3H-quinazolin-4-one13794-72-475 % similar 6-Acetoxy-4-chloro-7-methoxyquinazoline230955-75-658 % similar 7-Benzyloxy-6-methoxy-3H-quinazolin-4-one179688-01-857 % similar 5,6-Dimethoxybenzimidazole72721-02-944 % similar 2-Methoxyphenyl acetate15212-03-041 % similar Acetovanillin881-68-540 % similar 7-Fluoro-6-nitroquinazolin-4(1H)-one162012-69-340 % similar Acetylisoeugenol93-29-840 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Ethyl 5-nitroindole-2-carboxylate16732-57-3 Ethyl 7-nitroindole-2-carboxylate6960-46-9

Elsewhere

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