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TPEN (TPEDA) 25mg

CAT: 0628-A11980-25Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0628-A11980-25Size:25 mg
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CAS Number
16858-02-9

Chemical Information

N,N,N',N'-Tetrakis(2-pyridylmethyl)ethylenediamine

N,N,N',N'-tetrakis(2-pyridylmethyl)ethylenediamine is an N-substituted diamine that is ethylenediamine in which the four amino hydrogens are replaced by 2-pyridylmethyl groups. It has a role as a copper chelator, a chelator and an apoptosis inducer. It is a member of pyridines, a N-substituted diamine and a tertiary amino compound. It is functionally related to an ethylenediamine.

CAS Number16858-02-9
PubChem CID5519
IUPAC NameN,N,N',N'-tetrakis(pyridin-2-ylmethyl)ethane-1,2-diamine
Molecular FormulaC26H28N6
Molecular Weight424.5
XLogP2.1
Topological Polar Surface Area58
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count11
Heavy Atom Count32
Formal Charge0
Complexity419
SMILES
C1=CC=NC(=C1)CN(CCN(CC2=CC=CC=N2)CC3=CC=CC=N3)CC4=CC=CC=N4
InChI
InChI=1S/C26H28N6/c1-5-13-27-23(9-1)19-31(20-24-10-2-6-14-28-24)17-18-32(21-25-11-3-7-15-29-25)22-26-12-4-8-16-30-26/h1-16H,17-22H2
InChIKey
CVRXLMUYFMERMJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N,N,N',N'-Tetrakis(2-pyridylmethyl)ethylenediamine
CAS: 16858-02-9
CID: 5519
Formula: C26H28N6
MW: 424.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight424.5
XLogP32.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count11
Exact Mass424.23754492
Monoisotopic Mass424.23754492
Topological Polar Surface Area58 Ų
Heavy Atom Count32
Formal Charge0
Complexity419
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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CatalogName
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