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3-Iodo-7-azaindole

CAT: 0013-GTR19254221-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19254221-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
3-Iodo-7-azaindole , with CAS No. 23616-57-1, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. 3-Iodo-7-azaindole provides a structural basis and research tool for the design and screening of novel drug candidates, and is commonly used in drug discovery, drug synthesis, and related research.
CAS Number
23616-57-1
Product Name Alternative
Compound 23616 57 1, Compound 23616571
Purity
99.08% (May vary between batches)
Smiles
IC1=CNC2=NC=CC=C12
Molecular Formula
C7H5IN2
Molecular Weight
244.035
Storage Conditions
Powder: -20°C for 3 years | In solvent: -80°C for 1 year | Shipping with blue ice/Shipping at ambient temperature.
Notes
For research use only.

Chemical Information

3-Iodo-7-azaindole
CAS Number23616-57-1
PubChem CID5377078
IUPAC Name3-iodo-1H-pyrrolo[2,3-b]pyridine
Molecular FormulaC7H5IN2
Molecular Weight244.03
XLogP2
Topological Polar Surface Area28.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count10
Formal Charge0
Complexity129
SMILES
C1=CC2=C(NC=C2I)N=C1
InChI
InChI=1S/C7H5IN2/c8-6-4-10-7-5(6)2-1-3-9-7/h1-4H,(H,9,10)
InChIKey
BTIANIFSBYIGPA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Iodo-7-azaindole
CAS: 23616-57-1
CID: 5377078
Formula: C7H5IN2
MW: 244.03
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight244.03
XLogP32
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass243.94975
Monoisotopic Mass243.94975
Topological Polar Surface Area28.7 Ų
Heavy Atom Count10
Formal Charge0
Complexity129
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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