chempirical

5,7-Dichloropyrazolo[1,5-A]pyrimidine

C6H3Cl2N3CAS 57489-77-7188.01 g/mol

Open in Covalent MOL file
NNNClCl
Aryl halide

Properties

Molecular formula
C6H3Cl2N3
Molar mass
188.01 g/mol
Exact mass
186.9704 Da
logP
2.04Crippen estimate
Polar surface area
30.2 Ų
H-bond donors / acceptors
0 / 2
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
57489-77-7
SMILES
C1=C2N=C(C=C(N2N=C1)Cl)Cl
InChIKey
JMTFWCYVZOFHLR-UHFFFAOYSA-N
InChI
InChI=1S/C6H3Cl2N3/c7-4-3-5(8)11-6(10-4)1-2-9-11/h1-3H

Weigh it out

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Work with 5,7-Dichloropyrazolo[1,5-A]pyrimidine

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

7-Chloropyrazolo[1,5-A]pyrimidine58347-49-253 % similar 5-Chloropyrazolo(1,5-a)pyrimidine29274-24-647 % similar 2,4,6-Trichloropyrimidine3764-01-033 % similar 2,4,6-Trichloropyridine16063-69-732 % similar B-(2,6-Dichloro-4-pyridinyl)boronic acid1072951-54-231 % similar 4,6-Dichloro-2-(methylthio)pyrimidine6299-25-831 % similar Fenclorim3740-92-931 % similar 2-Amino-4-chloropyrimidine3993-78-031 % similar

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

Same formula

4,5-Dichloro-7H-pyrrolo[2,3-D]pyrimidine115093-90-8 5,7-Dichloro-1H-imidazo[4,5-b]pyridine24485-01-6 4,6-Dichloroimidazo[4,5-C]pyridine2589-12-0 5,7-Dichloro-imidazo[1,2-A]pyrimidine57473-32-2 2,4-Dichloro-5H-pyrrolo[3,2-D]pyrimidine63200-54-4 2,4-Dichloro-7H-pyrrolo[2,3-d]pyrimidine90213-66-4 2,4-Dichloropyrrolo[2,1-f][1,2,4]triazine918538-05-3

Elsewhere

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