9-Aminoacridine hydrochloride monohydrate

C₁₃H₁₃ClN₂OCAS 52417-22-8248.71 g/mol

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Properties

Molecular formula: C₁₃H₁₃ClN₂O
Molar mass: 248.71 g/mol
Exact mass: 248.0716 Da
logP: 2.40Crippen estimate
Polar surface area: 71.1 Å²
H-bond donors / acceptors: 2 / 1
Rotatable bonds: 0

Identifiers

CAS number

52417-22-8

SMILES

Cl.N=c1c2ccccc2[nH]c2ccccc12.O

InChIKey

OREJEGKBQBIJSJ-UHFFFAOYSA-N

InChI

InChI=1S/C13H10N2.ClH.H2O/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13;;/h1-8H,(H2,14,15);1H;1H2

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Names and synonyms

2 names

9-Acridinamine, hydrochloride, hydrate (1:1:1)
9-Acridinamine, monohydrochloride, monohydrate

Work with 9-Aminoacridine hydrochloride monohydrate

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

Tacrine hydrochloride1684-40-854 % similar Tacrine321-64-246 % similar 5,7-Dihydroindolo(2,3-b)carbazole111296-90-342 % similar 2-Amino-9H-pyrido[2,3-B]indole26148-68-539 % similar 2-Amino-4-hydroxyquinoline42712-64-139 % similar 5H-Benzo[B]carbazole243-28-738 % similar 4-Amino-2-methylquinoline6628-04-238 % similar Quinacridone1047-16-137 % similar

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

Same formula

Harmine hydrochloride343-27-1 Ex 52749843-98-3

Elsewhere

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