sodium;cobalt(3+);2-N,6-N-dipyridin-4-ylpyridine-2,6-dicarboximidate;6-N-pyridin-3-yl-2-N-pyridin-4-ylpyridine-2,6-dicarboximidate

C34H22CoN10NaO4 — CID 25146511

IUPACsodium;cobalt(3+);2-N,6-N-dipyridin-4-ylpyridine-2,6-dicarboximidate;6-N-pyridin-3-yl-2-N-pyridin-4-ylpyridine-2,6-dicarboximidate
SMILES[Co+3].[Na+].[O-]/C(=N\c1cccnc1)c1cccc(/C([O-])=N\c2ccncc2)n1.[O-]/C(=N\c1ccncc1)c1cccc(/C([O-])=N\c2ccncc2)n1
InChIInChI=1S/2C17H13N5O2.Co.Na/c23-16(20-12-6-9-18-10-7-12)14-4-1-5-15(22-14)17(24)21-13-3-2-8-19-11-13;23-16(20-12-4-8-18-9-5-12)14-2-1-3-15(22-14)17(24)21-13-6-10-19-11-7-13;;/h1-11H,(H,21,24)(H,18,20,23);1-11H,(H,18,20,23)(H,19,21,24);;/q;;+3;+1/p-4
InChIKeyWWYWADQTUUCOMH-UHFFFAOYSA-J
MW716.54 g/mol
LogP-1.50
Rot. Bonds8

About sodium;cobalt(3+);2-N,6-N-dipyridin-4-ylpyridine-2,6-dicarboximidate;6-N-pyridin-3-yl-2-N-pyridin-4-ylpyridine-2,6-dicarboximidate

sodium;cobalt(3+);2-N,6-N-dipyridin-4-ylpyridine-2,6-dicarboximidate;6-N-pyridin-3-yl-2-N-pyridin-4-ylpyridine-2,6-dicarboximidate (PubChem CID 25146511) has the molecular formula C34H22CoN10NaO4 and a molecular weight of 716.54 g/mol. Its IUPAC name is sodium;cobalt(3+);2-N,6-N-dipyridin-4-ylpyridine-2,6-dicarboximidate;6-N-pyridin-3-yl-2-N-pyridin-4-ylpyridine-2,6-dicarboximidate.

Molecular Properties

Compound Namesodium;cobalt(3+);2-N,6-N-dipyridin-4-ylpyridine-2,6-dicarboximidate;6-N-pyridin-3-yl-2-N-pyridin-4-ylpyridine-2,6-dicarboximidate
PubChem CID25146511
Molecular FormulaC34H22CoN10NaO4
Molecular Weight716.54 g/mol
Exact Mass716.11
IUPAC Namesodium;cobalt(3+);2-N,6-N-dipyridin-4-ylpyridine-2,6-dicarboximidate;6-N-pyridin-3-yl-2-N-pyridin-4-ylpyridine-2,6-dicarboximidate
SMILES[Co+3].[Na+].[O-]/C(=N\c1cccnc1)c1cccc(/C([O-])=N\c2ccncc2)n1.[O-]/C(=N\c1ccncc1)c1cccc(/C([O-])=N\c2ccncc2)n1
InChIInChI=1S/2C17H13N5O2.Co.Na/c23-16(20-12-6-9-18-10-7-12)14-4-1-5-15(22-14)17(24)21-13-3-2-8-19-11-13;23-16(20-12-4-8-18-9-5-12)14-2-1-3-15(22-14)17(24)21-13-6-10-19-11-7-13;;/h1-11H,(H,21,24)(H,18,20,23);1-11H,(H,18,20,23)(H,19,21,24);;/q;;+3;+1/p-4
InChIKeyWWYWADQTUUCOMH-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+);2-N,6-N-dipyridin-4-ylpyridine-2,6-dicarboximidate;6-N-pyridin-3-yl-2-N-pyridin-4-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+);2-N,6-N-dipyridin-4-ylpyridine-2,6-dicarboximidate;6-N-pyridin-3-yl-2-N-pyridin-4-ylpyridine-2,6-dicarboximidate?
The IUPAC name of sodium;cobalt(3+);2-N,6-N-dipyridin-4-ylpyridine-2,6-dicarboximidate;6-N-pyridin-3-yl-2-N-pyridin-4-ylpyridine-2,6-dicarboximidate (CID 25146511) is sodium;cobalt(3+);2-N,6-N-dipyridin-4-ylpyridine-2,6-dicarboximidate;6-N-pyridin-3-yl-2-N-pyridin-4-ylpyridine-2,6-dicarboximidate.
What is the SMILES notation for sodium;cobalt(3+);2-N,6-N-dipyridin-4-ylpyridine-2,6-dicarboximidate;6-N-pyridin-3-yl-2-N-pyridin-4-ylpyridine-2,6-dicarboximidate?
The canonical SMILES for sodium;cobalt(3+);2-N,6-N-dipyridin-4-ylpyridine-2,6-dicarboximidate;6-N-pyridin-3-yl-2-N-pyridin-4-ylpyridine-2,6-dicarboximidate is [Co+3].[Na+].[O-]/C(=N\c1cccnc1)c1cccc(/C([O-])=N\c2ccncc2)n1.[O-]/C(=N\c1ccncc1)c1cccc(/C([O-])=N\c2ccncc2)n1.
What is the InChIKey of sodium;cobalt(3+);2-N,6-N-dipyridin-4-ylpyridine-2,6-dicarboximidate;6-N-pyridin-3-yl-2-N-pyridin-4-ylpyridine-2,6-dicarboximidate?
The InChIKey is WWYWADQTUUCOMH-UHFFFAOYSA-J. The full InChI is InChI=1S/2C17H13N5O2.Co.Na/c23-16(20-12-6-9-18-10-7-12)14-4-1-5-15(22-14)17(24)21-13-3-2-8-19-11-13;23-16(20-12-4-8-18-9-5-12)14-2-1-3-15(22-14)17(24)21-13-6-10-19-11-7-13;;/h1-11H,(H,21,24)(H,18,20,23);1-11H,(H,18,20,23)(H,19,21,24);;/q;;+3;+1/p-4.
What are the key properties of sodium;cobalt(3+);2-N,6-N-dipyridin-4-ylpyridine-2,6-dicarboximidate;6-N-pyridin-3-yl-2-N-pyridin-4-ylpyridine-2,6-dicarboximidate?
sodium;cobalt(3+);2-N,6-N-dipyridin-4-ylpyridine-2,6-dicarboximidate;6-N-pyridin-3-yl-2-N-pyridin-4-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+);2-N,6-N-dipyridin-4-ylpyridine-2,6-dicarboximidate;6-N-pyridin-3-yl-2-N-pyridin-4-ylpyridine-2,6-dicarboximidate is sourced from PubChem (CID 25146511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).