2-(1-methyl-5-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-yl-5-thiophen-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;tris(platinum(2+))

C117H72N12Pt3S6 — CID 157070656

IUPAC2-(1-methyl-5-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-yl-5-thiophen-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;tris(platinum(2+))
SMILESCn1c(-c2[c-]c3c(cc2)c2cc(-c4cccs4)ccc2n3-c2[c-]c(-c3ccccn3)ccc2)nc2cc(-c3cccs3)ccc21.Cn1c(-c2[c-]c3c(cc2)c2cc(-c4cccs4)ccc2n3-c2[c-]c(-c3ccccn3)ccc2)nc2ccc(-c3cccs3)cc21.Cn1c(-c2[c-]c3c(cc2)c2ccccc2n3-c2[c-]c(-c3ccccn3)cc(-c3cccs3)c2)nc2ccc(-c3cccs3)cc21.[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/3C39H24N4S2.3Pt/c1-42-36-23-27(38-11-6-20-45-38)13-16-33(36)41-39(42)28-12-15-30-31-22-26(37-10-5-19-44-37)14-17-34(31)43(35(30)24-28)29-8-4-7-25(21-29)32-9-2-3-18-40-32;1-42-35-17-14-27(38-11-6-20-45-38)23-33(35)41-39(42)28-12-15-30-31-22-26(37-10-5-19-44-37)13-16-34(31)43(36(30)24-28)29-8-4-7-25(21-29)32-9-2-3-18-40-32;1-42-36-23-25(37-11-6-18-44-37)14-16-33(36)41-39(42)26-13-15-31-30-8-2-3-10-34(30)43(35(31)24-26)29-21-27(32-9-4-5-17-40-32)20-28(22-29)38-12-7-19-45-38;;;/h3*2-20,22-23H,1H3;;;/q3*-2;3*+2
InChIKeyMASIQBQDOPTNLF-UHFFFAOYSA-N
MW2423.58 g/mol
LogP31.36
Rot. Bonds15

About 2-(1-methyl-5-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-yl-5-thiophen-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;tris(platinum(2+))

2-(1-methyl-5-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-yl-5-thiophen-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;tris(platinum(2+)) (PubChem CID 157070656) has the molecular formula C117H72N12Pt3S6 and a molecular weight of 2423.58 g/mol. Its IUPAC name is 2-(1-methyl-5-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-yl-5-thiophen-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;tris(platinum(2+)).

Molecular Properties

Compound Name2-(1-methyl-5-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-yl-5-thiophen-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;tris(platinum(2+))
PubChem CID157070656
Molecular FormulaC117H72N12Pt3S6
Molecular Weight2423.58 g/mol
Exact Mass2421.33
IUPAC Name2-(1-methyl-5-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-yl-5-thiophen-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;tris(platinum(2+))
SMILESCn1c(-c2[c-]c3c(cc2)c2cc(-c4cccs4)ccc2n3-c2[c-]c(-c3ccccn3)ccc2)nc2cc(-c3cccs3)ccc21.Cn1c(-c2[c-]c3c(cc2)c2cc(-c4cccs4)ccc2n3-c2[c-]c(-c3ccccn3)ccc2)nc2ccc(-c3cccs3)cc21.Cn1c(-c2[c-]c3c(cc2)c2ccccc2n3-c2[c-]c(-c3ccccn3)cc(-c3cccs3)c2)nc2ccc(-c3cccs3)cc21.[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/3C39H24N4S2.3Pt/c1-42-36-23-27(38-11-6-20-45-38)13-16-33(36)41-39(42)28-12-15-30-31-22-26(37-10-5-19-44-37)14-17-34(31)43(35(30)24-28)29-8-4-7-25(21-29)32-9-2-3-18-40-32;1-42-35-17-14-27(38-11-6-20-45-38)23-33(35)41-39(42)28-12-15-30-31-22-26(37-10-5-19-44-37)13-16-34(31)43(36(30)24-28)29-8-4-7-25(21-29)32-9-2-3-18-40-32;1-42-36-23-25(37-11-6-18-44-37)14-16-33(36)41-39(42)26-13-15-31-30-8-2-3-10-34(30)43(35(31)24-26)29-21-27(32-9-4-5-17-40-32)20-28(22-29)38-12-7-19-45-38;;;/h3*2-20,22-23H,1H3;;;/q3*-2;3*+2
InChIKeyMASIQBQDOPTNLF-UHFFFAOYSA-N
XLogP31.36
TPSA106.92 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds15
Heavy Atoms138
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002423.58
LogP ≤ 531.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

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

Analyze 2-(1-methyl-5-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-yl-5-thiophen-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;tris(platinum(2+)) with MolForge

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Related Compounds

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8-[1-(4-tert-butylphenyl)benzimidazol-2-yl]-3-fluoro-7H-[1]benzothiolo[2,3-b]pyridin-7-ide;8-[1-(2,6-dimethyl-4-pyridinyl)benzimidazol-2-yl]-2-fluoro-5-methyl-7H-[1]benzothiolo[2,3-b]pyridin-7-ide;6-[1-[2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-3-(trifluoromethyl)-7H-[1]benzothiolo[3,2-c]pyridin-7-ide;4-fluoro-8-(1-naphthalen-1-ylbenzimidazol-2-yl)-7H-[1]benzothiolo[2,3-b]pyridin-7-ide;5-fluoro-2-propan-2-yl-8-[1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-7H-[1]benzothiolo[2,3-b]pyridin-7-ide;hexakis(iridium);1,3,5-trifluoro-8-(1-naphthalen-2-ylbenzimidazol-2-yl)-7H-[1]benzothiolo[2,3-c]pyridin-7-ide;tetrakis(trimethyl-(6-phenyl-3-pyridinyl)germane);bis(trimethyl-(6-phenyl-3-pyridinyl)silane)
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CID 158818180
CID 158910034
CID 158910034
3,7-Bis(2,6-dimethylphenyl)-2,8-dimethyl-11-(trifluoromethyl)-3,7,13-triazoniatricyclo[7.3.1.05,13]trideca-1(12),2,7,9(13),10-pentaene;3,7-bis(2,6-dimethylphenyl)-2,8,11-trimethyl-3,7,13-triazoniatricyclo[7.3.1.05,13]trideca-1(12),2,7,9(13),10-pentaene;10,18-dimethyl-3,25-diaza-10,18,27-triazoniaheptacyclo[14.10.1.03,11.04,9.012,27.017,25.019,24]heptacosa-4,6,8,10,12(27),13,15,17,19,21,23-undecaene;10,18-dithia-3,25,27-triazoniaheptacyclo[14.10.1.03,11.04,9.012,27.017,25.019,24]heptacosa-3(11),4,6,8,12(27),13,15,17(25),19,21,23-undecaene;3,19,21-triazoniapentacyclo[11.7.1.03,8.09,21.014,19]henicosa-3,5,7,9(21),10,12,14,16,18-nonaene;2,8,11-trimethyl-3,7-bis(2,4,6-trimethylphenyl)-3,7,13-triazoniatricyclo[7.3.1.05,13]trideca-1(12),2,7,9(13),10-pentaene
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Frequently Asked Questions

What is the IUPAC name of 2-(1-methyl-5-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-yl-5-thiophen-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;tris(platinum(2+))?
The IUPAC name of 2-(1-methyl-5-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-yl-5-thiophen-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;tris(platinum(2+)) (CID 157070656) is 2-(1-methyl-5-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-yl-5-thiophen-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;tris(platinum(2+)).
What is the SMILES notation for 2-(1-methyl-5-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-yl-5-thiophen-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;tris(platinum(2+))?
The canonical SMILES for 2-(1-methyl-5-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-yl-5-thiophen-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;tris(platinum(2+)) is Cn1c(-c2[c-]c3c(cc2)c2cc(-c4cccs4)ccc2n3-c2[c-]c(-c3ccccn3)ccc2)nc2cc(-c3cccs3)ccc21.Cn1c(-c2[c-]c3c(cc2)c2cc(-c4cccs4)ccc2n3-c2[c-]c(-c3ccccn3)ccc2)nc2ccc(-c3cccs3)cc21.Cn1c(-c2[c-]c3c(cc2)c2ccccc2n3-c2[c-]c(-c3ccccn3)cc(-c3cccs3)c2)nc2ccc(-c3cccs3)cc21.[Pt+2].[Pt+2].[Pt+2].
What is the InChIKey of 2-(1-methyl-5-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-yl-5-thiophen-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;tris(platinum(2+))?
The InChIKey is MASIQBQDOPTNLF-UHFFFAOYSA-N. The full InChI is InChI=1S/3C39H24N4S2.3Pt/c1-42-36-23-27(38-11-6-20-45-38)13-16-33(36)41-39(42)28-12-15-30-31-22-26(37-10-5-19-44-37)14-17-34(31)43(35(30)24-28)29-8-4-7-25(21-29)32-9-2-3-18-40-32;1-42-35-17-14-27(38-11-6-20-45-38)23-33(35)41-39(42)28-12-15-30-31-22-26(37-10-5-19-44-37)13-16-34(31)43(36(30)24-28)29-8-4-7-25(21-29)32-9-2-3-18-40-32;1-42-36-23-25(37-11-6-18-44-37)14-16-33(36)41-39(42)26-13-15-31-30-8-2-3-10-34(30)43(35(31)24-26)29-21-27(32-9-4-5-17-40-32)20-28(22-29)38-12-7-19-45-38;;;/h3*2-20,22-23H,1H3;;;/q3*-2;3*+2.
What are the key properties of 2-(1-methyl-5-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-yl-5-thiophen-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;tris(platinum(2+))?
2-(1-methyl-5-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-yl-5-thiophen-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;tris(platinum(2+)) has a molecular weight of 2423.58 g/mol, XLogP of 31.36, 15 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methyl-5-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-thiophen-2-yl-1H-carbazol-1-ide;2-(1-methyl-6-thiophen-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-yl-5-thiophen-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;tris(platinum(2+)) is sourced from PubChem (CID 157070656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).