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Ciproxifan maleate

CAT: 0607-B1028-5Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0607-B1028-5Size:5 mg
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Description
Potent histamine H3 receptor antagonist
CAS Number
184025-19-2
Product Name Alternative
(Z)-but-2-enedioic acid;cyclopropyl-[4-[3-(1H-imidazol-5-yl)propoxy]phenyl]methanone
Field of Research
Neuroscience Histamine Receptor
Purity
0.98
Solubility
Soluble in DMSO
Smiles
C1CC1C(=O)C2=CC=C(C=C2)OCCCC3=CN=CN3.C(=CC(=O)O)C(=O)O
Molecular Formula
C20H22N2O6
Molecular Weight
386.4
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

Ciproxifan maleate
CAS Number184025-19-2
PubChem CID16219152
IUPAC Name(Z)-but-2-enedioic acid;cyclopropyl-[4-[3-(1H-imidazol-5-yl)propoxy]phenyl]methanone
Molecular FormulaC20H22N2O6
Molecular Weight386.4
Topological Polar Surface Area130
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count9
Heavy Atom Count28
Formal Charge0
Complexity441
SMILES
C1CC1C(=O)C2=CC=C(C=C2)OCCCC3=CN=CN3.C(=C\C(=O)O)\C(=O)O
InChI
InChI=1S/C16H18N2O2.C4H4O4/c19-16(12-3-4-12)13-5-7-15(8-6-13)20-9-1-2-14-10-17-11-18-14;5-3(6)1-2-4(7)8/h5-8,10-12H,1-4,9H2,(H,17,18);1-2H,(H,5,6)(H,7,8)/b;2-1-
InChIKey
RLQFKEYRALXXEJ-BTJKTKAUSA-N
Chemical Structure
2D Structure
2D structure of Ciproxifan maleate
CAS: 184025-19-2
CID: 16219152
Formula: C20H22N2O6
MW: 386.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight386.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count9
Exact Mass386.14778643
Monoisotopic Mass386.14778643
Topological Polar Surface Area130 Ų
Heavy Atom Count28
Formal Charge0
Complexity441
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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