silver;1-[2-[[4-[2,2-di(pyrazol-1-yl)ethoxymethyl]phenyl]methoxy]-1-pyrazol-1-ylethyl]pyrazole;tetrafluoroborate

C24H26AgBF4N8O2 — CID 139126379

About silver;1-[2-[[4-[2,2-di(pyrazol-1-yl)ethoxymethyl]phenyl]methoxy]-1-pyrazol-1-ylethyl]pyrazole;tetrafluoroborate

silver;1-[2-[[4-[2,2-di(pyrazol-1-yl)ethoxymethyl]phenyl]methoxy]-1-pyrazol-1-ylethyl]pyrazole;tetrafluoroborate (PubChem CID 139126379) has the molecular formula C24H26AgBF4N8O2 and a molecular weight of 653.20 g/mol. Its IUPAC name is silver;1-[2-[[4-[2,2-di(pyrazol-1-yl)ethoxymethyl]phenyl]methoxy]-1-pyrazol-1-ylethyl]pyrazole;tetrafluoroborate.

Molecular Properties

• Compound Name: silver;1-[2-[[4-[2,2-di(pyrazol-1-yl)ethoxymethyl]phenyl]methoxy]-1-pyrazol-1-ylethyl]pyrazole;tetrafluoroborate
• PubChem CID: 139126379
• Molecular Formula: C24H26AgBF4N8O2
• Molecular Weight: 653.20 g/mol
• Exact Mass: 652.13
• IUPAC Name: silver;1-[2-[[4-[2,2-di(pyrazol-1-yl)ethoxymethyl]phenyl]methoxy]-1-pyrazol-1-ylethyl]pyrazole;tetrafluoroborate
• SMILES: F[B-](F)(F)F.[Ag+].c1cnn(C(COCc2ccc(COCC(n3cccn3)n3cccn3)cc2)n2cccn2)c1
• InChI: InChI=1S/C24H26N8O2.Ag.BF4/c1-9-25-29(13-1)23(30-14-2-10-26-30)19-33-17-21-5-7-22(8-6-21)18-34-20-24(31-15-3-11-27-31)32-16-4-12-28-32;;2-1(3,4)5/h1-16,23-24H,17-20H2;;/q;+1;-1
• InChIKey: LJGWABCVDXAAPC-UHFFFAOYSA-N
• XLogP: 4.30
• TPSA: 89.74 Ų
• H-Bond Acceptors: 10
• Rotatable Bonds: 12
• Heavy Atoms: 40
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	653.20
LogP ≤ 5	4.30
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	10

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of silver;1-[2-[[4-[2,2-di(pyrazol-1-yl)ethoxymethyl]phenyl]methoxy]-1-pyrazol-1-ylethyl]pyrazole;tetrafluoroborate?

The IUPAC name of silver;1-[2-[[4-[2,2-di(pyrazol-1-yl)ethoxymethyl]phenyl]methoxy]-1-pyrazol-1-ylethyl]pyrazole;tetrafluoroborate (CID 139126379) is silver;1-[2-[[4-[2,2-di(pyrazol-1-yl)ethoxymethyl]phenyl]methoxy]-1-pyrazol-1-ylethyl]pyrazole;tetrafluoroborate.

What is the SMILES notation for silver;1-[2-[[4-[2,2-di(pyrazol-1-yl)ethoxymethyl]phenyl]methoxy]-1-pyrazol-1-ylethyl]pyrazole;tetrafluoroborate?

The canonical SMILES for silver;1-[2-[[4-[2,2-di(pyrazol-1-yl)ethoxymethyl]phenyl]methoxy]-1-pyrazol-1-ylethyl]pyrazole;tetrafluoroborate is F[B-](F)(F)F.[Ag+].c1cnn(C(COCc2ccc(COCC(n3cccn3)n3cccn3)cc2)n2cccn2)c1.

What is the InChIKey of silver;1-[2-[[4-[2,2-di(pyrazol-1-yl)ethoxymethyl]phenyl]methoxy]-1-pyrazol-1-ylethyl]pyrazole;tetrafluoroborate?

The InChIKey is LJGWABCVDXAAPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N8O2.Ag.BF4/c1-9-25-29(13-1)23(30-14-2-10-26-30)19-33-17-21-5-7-22(8-6-21)18-34-20-24(31-15-3-11-27-31)32-16-4-12-28-32;;2-1(3,4)5/h1-16,23-24H,17-20H2;;/q;+1;-1.

What are the key properties of silver;1-[2-[[4-[2,2-di(pyrazol-1-yl)ethoxymethyl]phenyl]methoxy]-1-pyrazol-1-ylethyl]pyrazole;tetrafluoroborate?

silver;1-[2-[[4-[2,2-di(pyrazol-1-yl)ethoxymethyl]phenyl]methoxy]-1-pyrazol-1-ylethyl]pyrazole;tetrafluoroborate has a molecular weight of 653.20 g/mol, XLogP of 4.30, 12 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for silver;1-[2-[[4-[2,2-di(pyrazol-1-yl)ethoxymethyl]phenyl]methoxy]-1-pyrazol-1-ylethyl]pyrazole;tetrafluoroborate is sourced from PubChem (CID 139126379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).