4,5-Diamino-6-hydroxypyrimidine

C₄H₆N₄OCAS 1672-50-0126.12 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₄H₆N₄O
Molar mass: 126.12 g/mol
Exact mass: 126.0542 Da
logP: -1.07Crippen estimate
Polar surface area: 97.8 Å²
H-bond donors / acceptors: 3 / 4
Rotatable bonds: 0

Identifiers

CAS number

1672-50-0

SMILES

C1=NC(=C(C(=O)N1)N)N

InChIKey

PWRHKLKFADDKHS-UHFFFAOYSA-N

InChI

InChI=1S/C4H6N4O/c5-2-3(6)7-1-8-4(2)9/h1H,5H2,(H3,6,7,8,9)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

4,5-Diaminohypoxanthine

Work with 4,5-Diamino-6-hydroxypyrimidine

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

4,5,6-Pyrimidinetriamine118-70-753 % similar 4,5,6-Triaminopyrimidine sulfate49721-45-145 % similar Thieno(2,3-d)pyrimidin-4(3H)-one14080-50-340 % similar 7-Deazaadenine1500-85-239 % similar Adenine73-24-539 % similar 3H,4H-Thieno[3,2-d]pyrimidin-4-one16234-10-936 % similar Adenine hydrochloride2922-28-336 % similar 4,6-Diamino-5-nitropyrimidine2164-84-335 % similar

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

Same formula

6-Hydrazinyl-2(1H)-pyrimidinone3310-41-6 5-Aminoimidazole-4-carboxamide360-97-4 2,4-Diamino-6-hydroxypyrimidine56-06-4 2,4-Diaminopyrimidine 3-N-oxide74638-76-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook