2,6-Dichloro-9-methyl-9H-purine

C₆H₄Cl₂N₄CAS 2382-10-7203.03 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₄Cl₂N₄
Molar mass: 203.03 g/mol
Exact mass: 201.9813 Da
logP: 1.67Crippen estimate
Polar surface area: 43.6 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 0

Hazards

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

Identifiers

CAS number

2382-10-7

SMILES

CN1C=NC2=C1N=C(N=C2Cl)Cl

InChIKey

HWMJNDVUIMQFEW-UHFFFAOYSA-N

InChI

InChI=1S/C6H4Cl2N4/c1-12-2-9-3-4(7)10-6(8)11-5(3)12/h2H,1H3

Weigh it out

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Work with 2,6-Dichloro-9-methyl-9H-purine

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-Chloro-9-methylpurine2346-74-961 % similar 2,4,6,8-Tetrachloropyrimido[5,4-d]pyrimidine32980-71-545 % similar (2R,3R,4S,5R)-2-(2,6-Dichloro-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol13276-52-340 % similar 9-Methyladenine700-00-539 % similar 5,7-Dichlorothiazolo(5,4-d)pyrimidine13479-88-439 % similar 2,4-Dichloropyrido[3,2-D]pyrimidine39551-54-738 % similar 2,4,6-Trichloro-5-methylpyrimidine1780-36-538 % similar 4-Bromo-1-methyl-1H-1,3-benzodiazole1353679-63-636 % similar

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

Same formula

2,6-Dichloro-7-methyl-7H-purine2273-93-0

Elsewhere

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