5-Bromo-4,6-dihydroxypyrimidine

C4H3BrN2O2CAS 15726-38-2190.98 g/mol

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NOHNBrOH
Aryl halidePhenol

Properties

Molecular formula
C4H3BrN2O2
Molar mass
190.98 g/mol
Exact mass
189.9378 Da
logP
0.24Crippen estimate
Polar surface area
66.0 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
0

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
15726-38-2
SMILES
C1=NC(=C(C(=O)N1)Br)O
InChIKey
XVXHFPZMRQXGBM-UHFFFAOYSA-N
InChI
InChI=1S/C4H3BrN2O2/c5-2-3(8)6-1-7-4(2)9/h1H,(H2,6,7,8,9)

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Work with 5-Bromo-4,6-dihydroxypyrimidine

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

4,6-Dihydroxy-5-methylpyrimidine63447-38-156 % similar 4,6-Dihydroxy-5-formylpyrimidine14256-99-653 % similar 4,6-Dihydroxy-5-methoxypyrimidine5193-84-051 % similar 7-Bromo-1H-quinazolin-4-one194851-16-638 % similar 7-Bromothieno(3,2-d)pyrimidin-4-ol31169-25-238 % similar 6-Bromoquinazolin-4-ol32084-59-638 % similar 4,5-Diamino-6-hydroxypyrimidine1672-50-037 % similar 9-Deazahypoxanthine5655-01-636 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

5-Bromo-1H-pyrazole-3-carboxylic acid1328893-16-8 4-Bromopyridazine-3,6-diol15456-86-7 5-Bromouracil51-20-7

Elsewhere

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