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Picloxydine

CAT: 0607-BA1595-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0607-BA1595-10Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
5636-92-0
Form
A solid
Molecular Formula
C20H24Cl2N10
Molecular Weight
475.38
Shipping Conditions
Blue ice
Storage Conditions
-20°C.

Chemical Information

Picloxydine

Picloxydine is an organochlorine compound.

CAS Number5636-92-0
PubChem CID5748610
IUPAC Name1-N',4-N'-bis[N'-(4-chlorophenyl)carbamimidoyl]piperazine-1,4-dicarboximidamide
Molecular FormulaC20H24Cl2N10
Molecular Weight475.4
XLogP1.8
Topological Polar Surface Area160
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Heavy Atom Count32
Formal Charge0
Complexity667
SMILES
C1N(CCN(C1)/C(=N/C(=NC2=CC=C(C=C2)Cl)N)/N)/C(=N/C(=NC3=CC=C(C=C3)Cl)N)/N
InChI
InChI=1S/C20H24Cl2N10/c21-13-1-5-15(6-2-13)27-17(23)29-19(25)31-9-11-32(12-10-31)20(26)30-18(24)28-16-7-3-14(22)4-8-16/h1-8H,9-12H2,(H4,23,25,27,29)(H4,24,26,28,30)
InChIKey
YNCLPFSAZFGQCD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Picloxydine
CAS: 5636-92-0
CID: 5748610
Formula: C20H24Cl2N10
MW: 475.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight475.4
XLogP31.8
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Exact Mass474.1562462
Monoisotopic Mass474.1562462
Topological Polar Surface Area160 Ų
Heavy Atom Count32
Formal Charge0
Complexity667
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
M26376-01Picloxydine
EBA14750-01Picloxydine digluconate

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