3-(3H-1-benzofuran-3-id-4-yl)-N-phenyl-N-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-N-(3-furo[3,2-d][1,3]oxazol-6-ylprop-2-enyl)-N-phenylbenzene-2-id-1-amine;9-(3-phenylbenzene-2-id-1-yl)-2-pyridin-2-yl-1H-carbazol-1-ide;4-(3-pyrazol-1-ylbenzene-2-id-1-yl)-2-(3H-thiophen-3-id-4-yl)-3H-furo[3,2-b]pyrrol-3-ide;silver

C108H68Ag4N13O4S-11 — CID 157326171

About 3-(3H-1-benzofuran-3-id-4-yl)-N-phenyl-N-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-N-(3-furo[3,2-d][1,3]oxazol-6-ylprop-2-enyl)-N-phenylbenzene-2-id-1-amine;9-(3-phenylbenzene-2-id-1-yl)-2-pyridin-2-yl-1H-carbazol-1-ide;4-(3-pyrazol-1-ylbenzene-2-id-1-yl)-2-(3H-thiophen-3-id-4-yl)-3H-furo[3,2-b]pyrrol-3-ide;silver

3-(3H-1-benzofuran-3-id-4-yl)-N-phenyl-N-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-N-(3-furo[3,2-d][1,3]oxazol-6-ylprop-2-enyl)-N-phenylbenzene-2-id-1-amine;9-(3-phenylbenzene-2-id-1-yl)-2-pyridin-2-yl-1H-carbazol-1-ide;4-(3-pyrazol-1-ylbenzene-2-id-1-yl)-2-(3H-thiophen-3-id-4-yl)-3H-furo[3,2-b]pyrrol-3-ide;silver (PubChem CID 157326171) has the molecular formula C108H68Ag4N13O4S-11 and a molecular weight of 2075.36 g/mol. Its IUPAC name is 3-(3H-1-benzofuran-3-id-4-yl)-N-phenyl-N-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-N-(3-furo[3,2-d][1,3]oxazol-6-ylprop-2-enyl)-N-phenylbenzene-2-id-1-amine;9-(3-phenylbenzene-2-id-1-yl)-2-pyridin-2-yl-1H-carbazol-1-ide;4-(3-pyrazol-1-ylbenzene-2-id-1-yl)-2-(3H-thiophen-3-id-4-yl)-3H-furo[3,2-b]pyrrol-3-ide;silver.

Molecular Properties

• Compound Name: 3-(3H-1-benzofuran-3-id-4-yl)-N-phenyl-N-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-N-(3-furo[3,2-d][1,3]oxazol-6-ylprop-2-enyl)-N-phenylbenzene-2-id-1-amine;9-(3-phenylbenzene-2-id-1-yl)-2-pyridin-2-yl-1H-carbazol-1-ide;4-(3-pyrazol-1-ylbenzene-2-id-1-yl)-2-(3H-thiophen-3-id-4-yl)-3H-furo[3,2-b]pyrrol-3-ide;silver
• PubChem CID: 157326171
• Molecular Formula: C108H68Ag4N13O4S-11
• Molecular Weight: 2075.36 g/mol
• Exact Mass: 2070.15
• IUPAC Name: 3-(3H-1-benzofuran-3-id-4-yl)-N-phenyl-N-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-N-(3-furo[3,2-d][1,3]oxazol-6-ylprop-2-enyl)-N-phenylbenzene-2-id-1-amine;9-(3-phenylbenzene-2-id-1-yl)-2-pyridin-2-yl-1H-carbazol-1-ide;4-(3-pyrazol-1-ylbenzene-2-id-1-yl)-2-(3H-thiophen-3-id-4-yl)-3H-furo[3,2-b]pyrrol-3-ide;silver
• SMILES: Cn1cc(-c2[c-]c(N(C/[C-]=C/c3coc4ocnc34)c3ccccc3)ccc2)c2[n-]c[n+](C)c21.[Ag].[Ag].[Ag].[Ag].[c-]1c(-c2cccc3oc[c-]c23)cccc1N(c1[c-]c(-n2ccc3cccnc32)ccc1)c1ccccc1.[c-]1ccccc1-c1[c-]c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)ccc1.[c-]1cscc1-c1[c-]c2c(ccn2-c2[c-]c(-n3cccn3)ccc2)o1
• InChI: InChI=1S/C33H20N3O.C29H17N2.C27H21N5O2.C19H10N3OS.4Ag/c1-2-10-26(11-3-1)36(28-13-4-8-25(22-28)30-15-6-16-32-31(30)18-21-37-32)29-14-5-12-27(23-29)35-20-17-24-9-7-19-34-33(24)35;1-2-9-21(10-3-1)22-11-8-12-24(19-22)31-28-15-5-4-13-25(28)26-17-16-23(20-29(26)31)27-14-6-7-18-30-27;1-30-15-23(25-26(30)31(2)17-28-25)19-8-6-12-22(14-19)32(21-10-4-3-5-11-21)13-7-9-20-16-33-27-24(20)29-18-34-27;1-3-15(11-16(4-1)22-8-2-7-20-22)21-9-5-18-17(21)12-19(23-18)14-6-10-24-13-14;;;;/h1-17,19-21H;1-9,11-18H;3-6,8-12,15-18H,13H2,1-2H3;1-5,7-10,13H;;;;/q2*-3;-2;-3
• InChIKey: CQLRWIMNBFZQLP-UHFFFAOYSA-N
• XLogP: 24.57
• TPSA: 153.23 Ų
• H-Bond Acceptors: 16
• Rotatable Bonds: 17
• Heavy Atoms: 130
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2075.36
LogP ≤ 5	24.57
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'dyes5A(27)', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-(3H-1-benzofuran-3-id-4-yl)-N-phenyl-N-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-N-(3-furo[3,2-d][1,3]oxazol-6-ylprop-2-enyl)-N-phenylbenzene-2-id-1-amine;9-(3-phenylbenzene-2-id-1-yl)-2-pyridin-2-yl-1H-carbazol-1-ide;4-(3-pyrazol-1-ylbenzene-2-id-1-yl)-2-(3H-thiophen-3-id-4-yl)-3H-furo[3,2-b]pyrrol-3-ide;silver?

The IUPAC name of 3-(3H-1-benzofuran-3-id-4-yl)-N-phenyl-N-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-N-(3-furo[3,2-d][1,3]oxazol-6-ylprop-2-enyl)-N-phenylbenzene-2-id-1-amine;9-(3-phenylbenzene-2-id-1-yl)-2-pyridin-2-yl-1H-carbazol-1-ide;4-(3-pyrazol-1-ylbenzene-2-id-1-yl)-2-(3H-thiophen-3-id-4-yl)-3H-furo[3,2-b]pyrrol-3-ide;silver (CID 157326171) is 3-(3H-1-benzofuran-3-id-4-yl)-N-phenyl-N-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-N-(3-furo[3,2-d][1,3]oxazol-6-ylprop-2-enyl)-N-phenylbenzene-2-id-1-amine;9-(3-phenylbenzene-2-id-1-yl)-2-pyridin-2-yl-1H-carbazol-1-ide;4-(3-pyrazol-1-ylbenzene-2-id-1-yl)-2-(3H-thiophen-3-id-4-yl)-3H-furo[3,2-b]pyrrol-3-ide;silver.

What is the SMILES notation for 3-(3H-1-benzofuran-3-id-4-yl)-N-phenyl-N-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-N-(3-furo[3,2-d][1,3]oxazol-6-ylprop-2-enyl)-N-phenylbenzene-2-id-1-amine;9-(3-phenylbenzene-2-id-1-yl)-2-pyridin-2-yl-1H-carbazol-1-ide;4-(3-pyrazol-1-ylbenzene-2-id-1-yl)-2-(3H-thiophen-3-id-4-yl)-3H-furo[3,2-b]pyrrol-3-ide;silver?

The canonical SMILES for 3-(3H-1-benzofuran-3-id-4-yl)-N-phenyl-N-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-N-(3-furo[3,2-d][1,3]oxazol-6-ylprop-2-enyl)-N-phenylbenzene-2-id-1-amine;9-(3-phenylbenzene-2-id-1-yl)-2-pyridin-2-yl-1H-carbazol-1-ide;4-(3-pyrazol-1-ylbenzene-2-id-1-yl)-2-(3H-thiophen-3-id-4-yl)-3H-furo[3,2-b]pyrrol-3-ide;silver is Cn1cc(-c2[c-]c(N(C/[C-]=C/c3coc4ocnc34)c3ccccc3)ccc2)c2[n-]c[n+](C)c21.[Ag].[Ag].[Ag].[Ag].[c-]1c(-c2cccc3oc[c-]c23)cccc1N(c1[c-]c(-n2ccc3cccnc32)ccc1)c1ccccc1.[c-]1ccccc1-c1[c-]c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)ccc1.[c-]1cscc1-c1[c-]c2c(ccn2-c2[c-]c(-n3cccn3)ccc2)o1.

What is the InChIKey of 3-(3H-1-benzofuran-3-id-4-yl)-N-phenyl-N-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-N-(3-furo[3,2-d][1,3]oxazol-6-ylprop-2-enyl)-N-phenylbenzene-2-id-1-amine;9-(3-phenylbenzene-2-id-1-yl)-2-pyridin-2-yl-1H-carbazol-1-ide;4-(3-pyrazol-1-ylbenzene-2-id-1-yl)-2-(3H-thiophen-3-id-4-yl)-3H-furo[3,2-b]pyrrol-3-ide;silver?

The InChIKey is CQLRWIMNBFZQLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H20N3O.C29H17N2.C27H21N5O2.C19H10N3OS.4Ag/c1-2-10-26(11-3-1)36(28-13-4-8-25(22-28)30-15-6-16-32-31(30)18-21-37-32)29-14-5-12-27(23-29)35-20-17-24-9-7-19-34-33(24)35;1-2-9-21(10-3-1)22-11-8-12-24(19-22)31-28-15-5-4-13-25(28)26-17-16-23(20-29(26)31)27-14-6-7-18-30-27;1-30-15-23(25-26(30)31(2)17-28-25)19-8-6-12-22(14-19)32(21-10-4-3-5-11-21)13-7-9-20-16-33-27-24(20)29-18-34-27;1-3-15(11-16(4-1)22-8-2-7-20-22)21-9-5-18-17(21)12-19(23-18)14-6-10-24-13-14;;;;/h1-17,19-21H;1-9,11-18H;3-6,8-12,15-18H,13H2,1-2H3;1-5,7-10,13H;;;;/q2*-3;-2;-3;;;;.

What are the key properties of 3-(3H-1-benzofuran-3-id-4-yl)-N-phenyl-N-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-N-(3-furo[3,2-d][1,3]oxazol-6-ylprop-2-enyl)-N-phenylbenzene-2-id-1-amine;9-(3-phenylbenzene-2-id-1-yl)-2-pyridin-2-yl-1H-carbazol-1-ide;4-(3-pyrazol-1-ylbenzene-2-id-1-yl)-2-(3H-thiophen-3-id-4-yl)-3H-furo[3,2-b]pyrrol-3-ide;silver?

3-(3H-1-benzofuran-3-id-4-yl)-N-phenyl-N-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-N-(3-furo[3,2-d][1,3]oxazol-6-ylprop-2-enyl)-N-phenylbenzene-2-id-1-amine;9-(3-phenylbenzene-2-id-1-yl)-2-pyridin-2-yl-1H-carbazol-1-ide;4-(3-pyrazol-1-ylbenzene-2-id-1-yl)-2-(3H-thiophen-3-id-4-yl)-3H-furo[3,2-b]pyrrol-3-ide;silver has a molecular weight of 2075.36 g/mol, XLogP of 24.57, 17 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(3H-1-benzofuran-3-id-4-yl)-N-phenyl-N-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-N-(3-furo[3,2-d][1,3]oxazol-6-ylprop-2-enyl)-N-phenylbenzene-2-id-1-amine;9-(3-phenylbenzene-2-id-1-yl)-2-pyridin-2-yl-1H-carbazol-1-ide;4-(3-pyrazol-1-ylbenzene-2-id-1-yl)-2-(3H-thiophen-3-id-4-yl)-3H-furo[3,2-b]pyrrol-3-ide;silver is sourced from PubChem (CID 157326171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).