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Compound FL0128

CAT: 0013-GTR19269718-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19269718-01Size:1 mg
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Description
Compound FL0128, with CAS No. 887625-09-4, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. Compound FL0128 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
887625-09-4
Purity
99.66% (May vary between batches)
Smiles
Nc1cn2nc (Cl) ccc2n1
Molecular Formula
C6H5ClN4
Molecular Weight
168.58
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-Amino-6-chloroimidazo[1,2-b]pyridazine
CAS Number887625-09-4
PubChem CID49758021
IUPAC Name6-chloroimidazo[1,2-b]pyridazin-2-amine
Molecular FormulaC6H5ClN4
Molecular Weight168.58
XLogP0.9
Topological Polar Surface Area56.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity154
SMILES
C1=CC(=NN2C1=NC(=C2)N)Cl
InChI
InChI=1S/C6H5ClN4/c7-4-1-2-6-9-5(8)3-11(6)10-4/h1-3H,8H2
InChIKey
VEHNVCGISXDBIG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Amino-6-chloroimidazo[1,2-b]pyridazine
CAS: 887625-09-4
CID: 49758021
Formula: C6H5ClN4
MW: 168.58
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight168.58
XLogP30.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass168.0202739
Monoisotopic Mass168.0202739
Topological Polar Surface Area56.2 Ų
Heavy Atom Count11
Formal Charge0
Complexity154
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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