sodium;cobalt(3+);bis(2-N,6-N-dipyridin-3-ylpyridine-2,6-dicarboximidate)

C34H22CoN10NaO4 — CID 25146602

IUPACsodium;cobalt(3+);bis(2-N,6-N-dipyridin-3-ylpyridine-2,6-dicarboximidate)
SMILES[Co+3].[Na+].[O-]/C(=N\c1cccnc1)c1cccc(/C([O-])=N/c2cccnc2)n1.[O-]/C(=N\c1cccnc1)c1cccc(/C([O-])=N\c2cccnc2)n1
InChIInChI=1S/2C17H13N5O2.Co.Na/c2*23-16(20-12-4-2-8-18-10-12)14-6-1-7-15(22-14)17(24)21-13-5-3-9-19-11-13;;/h2*1-11H,(H,20,23)(H,21,24);;/q;;+3;+1/p-4
InChIKeyYUOIQZVZLMTDHZ-UHFFFAOYSA-J
MW716.54 g/mol
LogP-1.50
Rot. Bonds8

About sodium;cobalt(3+);bis(2-N,6-N-dipyridin-3-ylpyridine-2,6-dicarboximidate)

sodium;cobalt(3+);bis(2-N,6-N-dipyridin-3-ylpyridine-2,6-dicarboximidate) (PubChem CID 25146602) has the molecular formula C34H22CoN10NaO4 and a molecular weight of 716.54 g/mol. Its IUPAC name is sodium;cobalt(3+);bis(2-N,6-N-dipyridin-3-ylpyridine-2,6-dicarboximidate).

Molecular Properties

Compound Namesodium;cobalt(3+);bis(2-N,6-N-dipyridin-3-ylpyridine-2,6-dicarboximidate)
PubChem CID25146602
Molecular FormulaC34H22CoN10NaO4
Molecular Weight716.54 g/mol
Exact Mass716.11
IUPAC Namesodium;cobalt(3+);bis(2-N,6-N-dipyridin-3-ylpyridine-2,6-dicarboximidate)
SMILES[Co+3].[Na+].[O-]/C(=N\c1cccnc1)c1cccc(/C([O-])=N/c2cccnc2)n1.[O-]/C(=N\c1cccnc1)c1cccc(/C([O-])=N\c2cccnc2)n1
InChIInChI=1S/2C17H13N5O2.Co.Na/c2*23-16(20-12-4-2-8-18-10-12)14-6-1-7-15(22-14)17(24)21-13-5-3-9-19-11-13;;/h2*1-11H,(H,20,23)(H,21,24);;/q;;+3;+1/p-4
InChIKeyYUOIQZVZLMTDHZ-UHFFFAOYSA-J
XLogP-1.50
TPSA219.02 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds8
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500716.54
LogP ≤ 5-1.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze sodium;cobalt(3+);bis(2-N,6-N-dipyridin-3-ylpyridine-2,6-dicarboximidate) with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of sodium;cobalt(3+);bis(2-N,6-N-dipyridin-3-ylpyridine-2,6-dicarboximidate)?
The IUPAC name of sodium;cobalt(3+);bis(2-N,6-N-dipyridin-3-ylpyridine-2,6-dicarboximidate) (CID 25146602) is sodium;cobalt(3+);bis(2-N,6-N-dipyridin-3-ylpyridine-2,6-dicarboximidate).
What is the SMILES notation for sodium;cobalt(3+);bis(2-N,6-N-dipyridin-3-ylpyridine-2,6-dicarboximidate)?
The canonical SMILES for sodium;cobalt(3+);bis(2-N,6-N-dipyridin-3-ylpyridine-2,6-dicarboximidate) is [Co+3].[Na+].[O-]/C(=N\c1cccnc1)c1cccc(/C([O-])=N/c2cccnc2)n1.[O-]/C(=N\c1cccnc1)c1cccc(/C([O-])=N\c2cccnc2)n1.
What is the InChIKey of sodium;cobalt(3+);bis(2-N,6-N-dipyridin-3-ylpyridine-2,6-dicarboximidate)?
The InChIKey is YUOIQZVZLMTDHZ-UHFFFAOYSA-J. The full InChI is InChI=1S/2C17H13N5O2.Co.Na/c2*23-16(20-12-4-2-8-18-10-12)14-6-1-7-15(22-14)17(24)21-13-5-3-9-19-11-13;;/h2*1-11H,(H,20,23)(H,21,24);;/q;;+3;+1/p-4.
What are the key properties of sodium;cobalt(3+);bis(2-N,6-N-dipyridin-3-ylpyridine-2,6-dicarboximidate)?
sodium;cobalt(3+);bis(2-N,6-N-dipyridin-3-ylpyridine-2,6-dicarboximidate) has a molecular weight of 716.54 g/mol, XLogP of -1.50, 8 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;cobalt(3+);bis(2-N,6-N-dipyridin-3-ylpyridine-2,6-dicarboximidate) is sourced from PubChem (CID 25146602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).