tris(2-pyrazin-2-ylpyrazine);ruthenium(2+);dichloride

C24H18Cl2N12Ru — CID 139034335

IUPACtris(2-pyrazin-2-ylpyrazine);ruthenium(2+);dichloride
SMILES[Cl-].[Cl-].[Ru+2].c1cnc(-c2cnccn2)cn1.c1cnc(-c2cnccn2)cn1.c1cnc(-c2cnccn2)cn1
InChIInChI=1S/3C8H6N4.2ClH.Ru/c3*1-3-11-7(5-9-1)8-6-10-2-4-12-8;;;/h3*1-6H;2*1H;/q;;;;;+2/p-2
InChIKeyXWSLUKLOHQAJCE-UHFFFAOYSA-L
MW646.47 g/mol
LogP-3.19
Rot. Bonds3

About tris(2-pyrazin-2-ylpyrazine);ruthenium(2+);dichloride

tris(2-pyrazin-2-ylpyrazine);ruthenium(2+);dichloride (PubChem CID 139034335) has the molecular formula C24H18Cl2N12Ru and a molecular weight of 646.47 g/mol. Its IUPAC name is tris(2-pyrazin-2-ylpyrazine);ruthenium(2+);dichloride.

Molecular Properties

Compound Nametris(2-pyrazin-2-ylpyrazine);ruthenium(2+);dichloride
PubChem CID139034335
Molecular FormulaC24H18Cl2N12Ru
Molecular Weight646.47 g/mol
Exact Mass646.02
IUPAC Nametris(2-pyrazin-2-ylpyrazine);ruthenium(2+);dichloride
SMILES[Cl-].[Cl-].[Ru+2].c1cnc(-c2cnccn2)cn1.c1cnc(-c2cnccn2)cn1.c1cnc(-c2cnccn2)cn1
InChIInChI=1S/3C8H6N4.2ClH.Ru/c3*1-3-11-7(5-9-1)8-6-10-2-4-12-8;;;/h3*1-6H;2*1H;/q;;;;;+2/p-2
InChIKeyXWSLUKLOHQAJCE-UHFFFAOYSA-L
XLogP-3.19
TPSA154.68 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds3
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500646.47
LogP ≤ 5-3.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze tris(2-pyrazin-2-ylpyrazine);ruthenium(2+);dichloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Tris(2,2'-bipyrazine)ruthenium(II) hexafluorophosphate
CID 15376884
[Ru(bpz)3][PF6]2, AldrichCPR
CID 117065413
Tris(2,2'-bipyrazyl)ruthenium(II)
CID 153668
Bis(2-pyrazin-4-ium-2-ylpyrazine);2-pyrazin-2-ylpyrazine;ruthenium(6+)
CID 138967859
Tris(2-pyrazin-2-ylpyrazine);ruthenium(2+)
CID 163196576
cis-Dichlorobis(2,2'-bipyrazyl)ruthenium(II)
CID 157351
Bis(2-methyl-6-(6-methylpyrazin-2-yl)pyrazine);2-methyl-6-pyrazin-2-ylpyrazine;ruthenium
CID 20805483
2-Pyrazin-2-yl-5-[6-(5-pyrazin-2-ylpyrazin-2-yl)-1,4-dithiin-2-yl]pyrazine
CID 58816815
Tetrakis(6-pyrazin-2-ylpyrazin-2-yl)silane
CID 71124248
2-Pyrazin-2-ylpyrazine;ruthenium
CID 135084578
Ru(bpz)3(Cl)2
CID 146159813
Bis(1-methanidyl-2-pyrazin-2-ylpyrazin-1-ium);2-pyrazin-2-ylpyrazine;ruthenium(2+)
CID 153475093

Frequently Asked Questions

What is the IUPAC name of tris(2-pyrazin-2-ylpyrazine);ruthenium(2+);dichloride?
The IUPAC name of tris(2-pyrazin-2-ylpyrazine);ruthenium(2+);dichloride (CID 139034335) is tris(2-pyrazin-2-ylpyrazine);ruthenium(2+);dichloride.
What is the SMILES notation for tris(2-pyrazin-2-ylpyrazine);ruthenium(2+);dichloride?
The canonical SMILES for tris(2-pyrazin-2-ylpyrazine);ruthenium(2+);dichloride is [Cl-].[Cl-].[Ru+2].c1cnc(-c2cnccn2)cn1.c1cnc(-c2cnccn2)cn1.c1cnc(-c2cnccn2)cn1.
What is the InChIKey of tris(2-pyrazin-2-ylpyrazine);ruthenium(2+);dichloride?
The InChIKey is XWSLUKLOHQAJCE-UHFFFAOYSA-L. The full InChI is InChI=1S/3C8H6N4.2ClH.Ru/c3*1-3-11-7(5-9-1)8-6-10-2-4-12-8;;;/h3*1-6H;2*1H;/q;;;;;+2/p-2.
What are the key properties of tris(2-pyrazin-2-ylpyrazine);ruthenium(2+);dichloride?
tris(2-pyrazin-2-ylpyrazine);ruthenium(2+);dichloride has a molecular weight of 646.47 g/mol, XLogP of -3.19, 3 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for tris(2-pyrazin-2-ylpyrazine);ruthenium(2+);dichloride is sourced from PubChem (CID 139034335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).