4-Chloro-5-cyclopropyl-7h-pyrrolo[2,3-d]pyrimidine

C9H8ClN3CAS 1207543-16-5193.63 g/mol

Open in Covalent MOL file
HNNNCl
Aryl halide

Properties

Molecular formula
C9H8ClN3
Molar mass
193.63 g/mol
Exact mass
193.0407 Da
logP
2.49Crippen estimate
Polar surface area
41.6 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

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
1207543-16-5
SMILES
C1CC1C2=CNC3=C2C(=NC=N3)Cl
InChIKey
SZKMEPJJSHVYIC-UHFFFAOYSA-N
InChI
InChI=1S/C9H8ClN3/c10-8-7-6(5-1-2-5)3-11-9(7)13-4-12-8/h3-5H,1-2H2,(H,11,12,13)

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Names and synonyms

1 names
  • Starbld0042820

Work with 4-Chloro-5-cyclopropyl-7h-pyrrolo[2,3-d]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

4,5-Dichloro-7H-pyrrolo[2,3-D]pyrimidine115093-90-857 % similar 4-Chloro-5-iodo-7H-pyrrol[2,3-D]pyrimidine123148-78-754 % similar 4-Chloro-5-methyl-7H-pyrrolo(2,3-d)pyrimidine1618-36-654 % similar 5-Bromo-4-chloro-7H-pyrrolo[2,3-D]pyrimidine22276-95-554 % similar 4-Chloro-7H-pyrrolo(2,3-d)pyrimidine-5-carbonitrile24391-41-150 % similar 4-Chloro-7H-pyrrolo[2,3-D]pyrimidine-5-carbaldehyde908287-21-850 % similar 4-Chloro-5-phenyl-7H-pyrrolo[2,3-D]pyrimidine208459-81-849 % similar 4-Chloro-7H-pyrrolo(2,3-d)pyrimidine-5-carboxylic acid186519-92-647 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

7-Chloro-4-hydrazinylquinoline23834-14-2 5-Chloromethyl-2-(pyrazol-1-yl)pyridine748796-39-6 3-(4-Chlorophenyl)-1H-pyrazol-5-amine78583-81-0

Elsewhere

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