silver;acetonitrile;anthracene-9-carboxylate;bis(1H-imidazole)

C23H20AgN5O2 — CID 139158295

IUPACsilver;acetonitrile;anthracene-9-carboxylate;bis(1H-imidazole)
SMILESCC#N.O=C([O-])c1c2ccccc2cc2ccccc12.[Ag+].c1c[nH]cn1.c1c[nH]cn1
InChIInChI=1S/C15H10O2.2C3H4N2.C2H3N.Ag/c16-15(17)14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)14;2*1-2-5-3-4-1;1-2-3;/h1-9H,(H,16,17);2*1-3H,(H,4,5);1H3;/q;;;;+1/p-1
InChIKeyAEZNIORPQAHSSQ-UHFFFAOYSA-M
MW506.31 g/mol
LogP3.70
Rot. Bonds1

About silver;acetonitrile;anthracene-9-carboxylate;bis(1H-imidazole)

silver;acetonitrile;anthracene-9-carboxylate;bis(1H-imidazole) (PubChem CID 139158295) has the molecular formula C23H20AgN5O2 and a molecular weight of 506.31 g/mol. Its IUPAC name is silver;acetonitrile;anthracene-9-carboxylate;bis(1H-imidazole).

Molecular Properties

Compound Namesilver;acetonitrile;anthracene-9-carboxylate;bis(1H-imidazole)
PubChem CID139158295
Molecular FormulaC23H20AgN5O2
Molecular Weight506.31 g/mol
Exact Mass505.07
IUPAC Namesilver;acetonitrile;anthracene-9-carboxylate;bis(1H-imidazole)
SMILESCC#N.O=C([O-])c1c2ccccc2cc2ccccc12.[Ag+].c1c[nH]cn1.c1c[nH]cn1
InChIInChI=1S/C15H10O2.2C3H4N2.C2H3N.Ag/c16-15(17)14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)14;2*1-2-5-3-4-1;1-2-3;/h1-9H,(H,16,17);2*1-3H,(H,4,5);1H3;/q;;;;+1/p-1
InChIKeyAEZNIORPQAHSSQ-UHFFFAOYSA-M
XLogP3.70
TPSA121.28 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500506.31
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze silver;acetonitrile;anthracene-9-carboxylate;bis(1H-imidazole) 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

1H-imidazole;naphthalene-1,2-dicarboxylic acid
CID 69093080
1H-imidazole;naphthalene-1-sulfonic acid
CID 122441142
hexakis(anthracene-9-carboxylate);bis(erbium(3+));bis(1,10-phenanthroline)
CID 139060480
sodium;1H-imidazole;acetate
CID 68723506
magnesium;1H-imidazole;diacetate
CID 174869579
acetonitrile;9-anthracen-9-ylanthracene
CID 71362371
benzene-1,2,4,5-tetracarboxylic acid;cobalt;tetrakis(1H-imidazole);dihydrate
CID 4961424
1H-imidazole;dihydrate
CID 67700139
1H-imidazole;isoquinoline
CID 67481109
bis(1H-imidazole);quinoline
CID 174662508
disodium bis(2-sulfonaphthalene-1-carboxylate)
CID 162184312
bis(1H-imidazole);propanoic acid
CID 23342234

Frequently Asked Questions

What is the IUPAC name of silver;acetonitrile;anthracene-9-carboxylate;bis(1H-imidazole)?
The IUPAC name of silver;acetonitrile;anthracene-9-carboxylate;bis(1H-imidazole) (CID 139158295) is silver;acetonitrile;anthracene-9-carboxylate;bis(1H-imidazole).
What is the SMILES notation for silver;acetonitrile;anthracene-9-carboxylate;bis(1H-imidazole)?
The canonical SMILES for silver;acetonitrile;anthracene-9-carboxylate;bis(1H-imidazole) is CC#N.O=C([O-])c1c2ccccc2cc2ccccc12.[Ag+].c1c[nH]cn1.c1c[nH]cn1.
What is the InChIKey of silver;acetonitrile;anthracene-9-carboxylate;bis(1H-imidazole)?
The InChIKey is AEZNIORPQAHSSQ-UHFFFAOYSA-M. The full InChI is InChI=1S/C15H10O2.2C3H4N2.C2H3N.Ag/c16-15(17)14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)14;2*1-2-5-3-4-1;1-2-3;/h1-9H,(H,16,17);2*1-3H,(H,4,5);1H3;/q;;;;+1/p-1.
What are the key properties of silver;acetonitrile;anthracene-9-carboxylate;bis(1H-imidazole)?
silver;acetonitrile;anthracene-9-carboxylate;bis(1H-imidazole) has a molecular weight of 506.31 g/mol, XLogP of 3.70, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for silver;acetonitrile;anthracene-9-carboxylate;bis(1H-imidazole) is sourced from PubChem (CID 139158295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).