tetrasilver;tetrakis([6-[hydroxy(dipyridin-2-yl)methyl]-2-pyridinyl]-dipyridin-2-ylmethanol);tetranitrate

C108H84Ag4N24O20 — CID 139128020

IUPACtetrasilver;tetrakis([6-[hydroxy(dipyridin-2-yl)methyl]-2-pyridinyl]-dipyridin-2-ylmethanol);tetranitrate
SMILESO=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].OC(c1ccccn1)(c1ccccn1)c1cccc(C(O)(c2ccccn2)c2ccccn2)n1.OC(c1ccccn1)(c1ccccn1)c1cccc(C(O)(c2ccccn2)c2ccccn2)n1.OC(c1ccccn1)(c1ccccn1)c1cccc(C(O)(c2ccccn2)c2ccccn2)n1.OC(c1ccccn1)(c1ccccn1)c1cccc(C(O)(c2ccccn2)c2ccccn2)n1.[Ag+].[Ag+].[Ag+].[Ag+]
InChIInChI=1S/4C27H21N5O2.4Ag.4NO3/c4*33-26(20-10-1-5-16-28-20,21-11-2-6-17-29-21)24-14-9-15-25(32-24)27(34,22-12-3-7-18-30-22)23-13-4-8-19-31-23;;;;;4*2-1(3)4/h4*1-19,33-34H;;;;;;;;/q;;;;4*+1;4*-1
InChIKeyDCJLIAGCQMALFM-UHFFFAOYSA-N
MW2469.48 g/mol
LogP11.95
Rot. Bonds24

About tetrasilver;tetrakis([6-[hydroxy(dipyridin-2-yl)methyl]-2-pyridinyl]-dipyridin-2-ylmethanol);tetranitrate

tetrasilver;tetrakis([6-[hydroxy(dipyridin-2-yl)methyl]-2-pyridinyl]-dipyridin-2-ylmethanol);tetranitrate (PubChem CID 139128020) has the molecular formula C108H84Ag4N24O20 and a molecular weight of 2469.48 g/mol. Its IUPAC name is tetrasilver;tetrakis([6-[hydroxy(dipyridin-2-yl)methyl]-2-pyridinyl]-dipyridin-2-ylmethanol);tetranitrate.

Molecular Properties

Compound Nametetrasilver;tetrakis([6-[hydroxy(dipyridin-2-yl)methyl]-2-pyridinyl]-dipyridin-2-ylmethanol);tetranitrate
PubChem CID139128020
Molecular FormulaC108H84Ag4N24O20
Molecular Weight2469.48 g/mol
Exact Mass2464.25
IUPAC Nametetrasilver;tetrakis([6-[hydroxy(dipyridin-2-yl)methyl]-2-pyridinyl]-dipyridin-2-ylmethanol);tetranitrate
SMILESO=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].OC(c1ccccn1)(c1ccccn1)c1cccc(C(O)(c2ccccn2)c2ccccn2)n1.OC(c1ccccn1)(c1ccccn1)c1cccc(C(O)(c2ccccn2)c2ccccn2)n1.OC(c1ccccn1)(c1ccccn1)c1cccc(C(O)(c2ccccn2)c2ccccn2)n1.OC(c1ccccn1)(c1ccccn1)c1cccc(C(O)(c2ccccn2)c2ccccn2)n1.[Ag+].[Ag+].[Ag+].[Ag+]
InChIInChI=1S/4C27H21N5O2.4Ag.4NO3/c4*33-26(20-10-1-5-16-28-20,21-11-2-6-17-29-21)24-14-9-15-25(32-24)27(34,22-12-3-7-18-30-22)23-13-4-8-19-31-23;;;;;4*2-1(3)4/h4*1-19,33-34H;;;;;;;;/q;;;;4*+1;4*-1
InChIKeyDCJLIAGCQMALFM-UHFFFAOYSA-N
XLogP11.95
TPSA684.44 Ų
H-Bond Donors8
H-Bond Acceptors40
Rotatable Bonds24
Heavy Atoms156
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002469.48
LogP ≤ 511.95
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1040

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

Pyrinoline
CID 3052765
Disilver;bis(2,6-bis[methoxy(dipyridin-2-yl)methyl]pyridine);methanol;bis(trifluoromethanesulfonate)
CID 139128022
2,6-Bis[bis(2-pyridyl)hydroxymethyl]pyridine
CID 90820104
Tris(6-pyridin-2-yl-2-pyridinyl)methanol
CID 90818925
1,4-Bis[di(pyrid-2-yl)hydroxymethyl]benzene
CID 101341877
[2-[3,5-Bis[2-[hydroxy(dipyridin-2-yl)methyl]phenyl]phenyl]phenyl]-dipyridin-2-ylmethanol
CID 101777503
Pyridin-2-yl-bis(6-pyridin-2-yl-2-pyridinyl)methanol
CID 102494319
Bis[bis(2 pyridyl)hydroxymethyl]pyridine
CID 129773315
Bis(dipyridin-2-ylmethanediol);platinum(2+);dichloride;tetrahydrate
CID 139053883
Bis(2,2'-dipyridylmethanediol-N,N')palladium(II) Chloride Tetrahydrate
CID 139055522
Bis(di-2-pyridylmethandiol)copper(II) diperchlorate
CID 139056061
Bis[tris(pyridin-2-yl)methanol-kappa^2^N]palladium(II) dinitrate
CID 139059298

Frequently Asked Questions

What is the IUPAC name of tetrasilver;tetrakis([6-[hydroxy(dipyridin-2-yl)methyl]-2-pyridinyl]-dipyridin-2-ylmethanol);tetranitrate?
The IUPAC name of tetrasilver;tetrakis([6-[hydroxy(dipyridin-2-yl)methyl]-2-pyridinyl]-dipyridin-2-ylmethanol);tetranitrate (CID 139128020) is tetrasilver;tetrakis([6-[hydroxy(dipyridin-2-yl)methyl]-2-pyridinyl]-dipyridin-2-ylmethanol);tetranitrate.
What is the SMILES notation for tetrasilver;tetrakis([6-[hydroxy(dipyridin-2-yl)methyl]-2-pyridinyl]-dipyridin-2-ylmethanol);tetranitrate?
The canonical SMILES for tetrasilver;tetrakis([6-[hydroxy(dipyridin-2-yl)methyl]-2-pyridinyl]-dipyridin-2-ylmethanol);tetranitrate is O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].OC(c1ccccn1)(c1ccccn1)c1cccc(C(O)(c2ccccn2)c2ccccn2)n1.OC(c1ccccn1)(c1ccccn1)c1cccc(C(O)(c2ccccn2)c2ccccn2)n1.OC(c1ccccn1)(c1ccccn1)c1cccc(C(O)(c2ccccn2)c2ccccn2)n1.OC(c1ccccn1)(c1ccccn1)c1cccc(C(O)(c2ccccn2)c2ccccn2)n1.[Ag+].[Ag+].[Ag+].[Ag+].
What is the InChIKey of tetrasilver;tetrakis([6-[hydroxy(dipyridin-2-yl)methyl]-2-pyridinyl]-dipyridin-2-ylmethanol);tetranitrate?
The InChIKey is DCJLIAGCQMALFM-UHFFFAOYSA-N. The full InChI is InChI=1S/4C27H21N5O2.4Ag.4NO3/c4*33-26(20-10-1-5-16-28-20,21-11-2-6-17-29-21)24-14-9-15-25(32-24)27(34,22-12-3-7-18-30-22)23-13-4-8-19-31-23;;;;;4*2-1(3)4/h4*1-19,33-34H;;;;;;;;/q;;;;4*+1;4*-1.
What are the key properties of tetrasilver;tetrakis([6-[hydroxy(dipyridin-2-yl)methyl]-2-pyridinyl]-dipyridin-2-ylmethanol);tetranitrate?
tetrasilver;tetrakis([6-[hydroxy(dipyridin-2-yl)methyl]-2-pyridinyl]-dipyridin-2-ylmethanol);tetranitrate has a molecular weight of 2469.48 g/mol, XLogP of 11.95, 24 rotatable bonds, 8 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for tetrasilver;tetrakis([6-[hydroxy(dipyridin-2-yl)methyl]-2-pyridinyl]-dipyridin-2-ylmethanol);tetranitrate is sourced from PubChem (CID 139128020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).