2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-(5-thiophen-2-ylpyrimidin-2-yl)-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-3-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(1-methylpyrrol-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+))

C169H95N21O18Pt8S — CID 158788138

About 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-(5-thiophen-2-ylpyrimidin-2-yl)-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-3-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(1-methylpyrrol-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+))

2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-(5-thiophen-2-ylpyrimidin-2-yl)-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-3-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(1-methylpyrrol-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+)) (PubChem CID 158788138) has the molecular formula C169H95N21O18Pt8S and a molecular weight of 4300.44 g/mol. Its IUPAC name is 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-(5-thiophen-2-ylpyrimidin-2-yl)-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-3-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(1-methylpyrrol-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+)).

Molecular Properties

• Compound Name: 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-(5-thiophen-2-ylpyrimidin-2-yl)-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-3-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(1-methylpyrrol-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+))
• PubChem CID: 158788138
• Molecular Formula: C169H95N21O18Pt8S
• Molecular Weight: 4300.44 g/mol
• Exact Mass: 4297.41
• IUPAC Name: 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-(5-thiophen-2-ylpyrimidin-2-yl)-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-3-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(1-methylpyrrol-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+))
• SMILES: Cn1cccc1-c1cnc(-n2c3[c-]c(Oc4[c-]c(Oc5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c32)nc1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(Oc2[c-]c3c(cc2)c2ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c2n3-c2ncc(-c3ccco3)cn2)cccc1Oc1ccccn1.[c-]1c(Oc2[c-]c3c(cc2)c2ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c2n3-c2ncc(-c3cccs3)cn2)cccc1Oc1ccccn1.[c-]1c(Oc2[c-]c3c(cc2)c2ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c2n3-c2ncc(-c3ccoc3)cn2)cccc1Oc1ccccn1
• InChI: InChI=1S/C43H26N6O4.2C42H23N5O5.C42H23N5O4S.8Pt/c1-48-22-8-13-38(48)29-27-46-43(47-28-29)49-39-25-34(50-30-9-6-11-32(23-30)52-41-14-2-4-20-44-41)16-18-36(39)37-19-17-35(26-40(37)49)51-31-10-7-12-33(24-31)53-42-15-3-5-21-45-42;1-3-19-43-40(13-1)51-31-10-5-8-29(22-31)49-33-15-17-35-36-18-16-34(50-30-9-6-11-32(23-30)52-41-14-2-4-20-44-41)25-38(36)47(37(35)24-33)42-45-26-28(27-46-42)39-12-7-21-48-39;1-3-18-43-40(11-1)51-32-9-5-7-30(21-32)49-34-13-15-36-37-16-14-35(50-31-8-6-10-33(22-31)52-41-12-2-4-19-44-41)24-39(37)47(38(36)23-34)42-45-25-29(26-46-42)28-17-20-48-27-28;1-3-19-43-40(13-1)50-31-10-5-8-29(22-31)48-33-15-17-35-36-18-16-34(49-30-9-6-11-32(23-30)51-41-14-2-4-20-44-41)25-38(36)47(37(35)24-33)42-45-26-28(27-46-42)39-12-7-21-52-39;;;;;;;;/h2-22,27-28H,1H3;1-21,26-27H;1-20,25-27H;1-21,26-27H;;;;;;;;/q4*-4;8*+2
• InChIKey: JLPCEAXAHVAGEM-UHFFFAOYSA-N
• XLogP: 40.17
• TPSA: 404.85 Ų
• H-Bond Acceptors: 40
• Rotatable Bonds: 40
• Heavy Atoms: 217
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4300.44
LogP ≤ 5	40.17
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	40

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-(5-thiophen-2-ylpyrimidin-2-yl)-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-3-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(1-methylpyrrol-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+))?

The IUPAC name of 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-(5-thiophen-2-ylpyrimidin-2-yl)-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-3-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(1-methylpyrrol-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+)) (CID 158788138) is 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-(5-thiophen-2-ylpyrimidin-2-yl)-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-3-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(1-methylpyrrol-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+)).

What is the SMILES notation for 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-(5-thiophen-2-ylpyrimidin-2-yl)-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-3-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(1-methylpyrrol-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+))?

The canonical SMILES for 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-(5-thiophen-2-ylpyrimidin-2-yl)-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-3-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(1-methylpyrrol-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+)) is Cn1cccc1-c1cnc(-n2c3[c-]c(Oc4[c-]c(Oc5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c32)nc1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(Oc2[c-]c3c(cc2)c2ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c2n3-c2ncc(-c3ccco3)cn2)cccc1Oc1ccccn1.[c-]1c(Oc2[c-]c3c(cc2)c2ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c2n3-c2ncc(-c3cccs3)cn2)cccc1Oc1ccccn1.[c-]1c(Oc2[c-]c3c(cc2)c2ccc(Oc4[c-]c(Oc5ccccn5)ccc4)[c-]c2n3-c2ncc(-c3ccoc3)cn2)cccc1Oc1ccccn1.

What is the InChIKey of 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-(5-thiophen-2-ylpyrimidin-2-yl)-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-3-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(1-methylpyrrol-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+))?

The InChIKey is JLPCEAXAHVAGEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H26N6O4.2C42H23N5O5.C42H23N5O4S.8Pt/c1-48-22-8-13-38(48)29-27-46-43(47-28-29)49-39-25-34(50-30-9-6-11-32(23-30)52-41-14-2-4-20-44-41)16-18-36(39)37-19-17-35(26-40(37)49)51-31-10-7-12-33(24-31)53-42-15-3-5-21-45-42;1-3-19-43-40(13-1)51-31-10-5-8-29(22-31)49-33-15-17-35-36-18-16-34(50-30-9-6-11-32(23-30)52-41-14-2-4-20-44-41)25-38(36)47(37(35)24-33)42-45-26-28(27-46-42)39-12-7-21-48-39;1-3-18-43-40(11-1)51-32-9-5-7-30(21-32)49-34-13-15-36-37-16-14-35(50-31-8-6-10-33(22-31)52-41-12-2-4-19-44-41)24-39(37)47(38(36)23-34)42-45-25-29(26-46-42)28-17-20-48-27-28;1-3-19-43-40(13-1)50-31-10-5-8-29(22-31)48-33-15-17-35-36-18-16-34(49-30-9-6-11-32(23-30)51-41-14-2-4-20-44-41)25-38(36)47(37(35)24-33)42-45-26-28(27-46-42)39-12-7-21-52-39;;;;;;;;/h2-22,27-28H,1H3;1-21,26-27H;1-20,25-27H;1-21,26-27H;;;;;;;;/q4*-4;8*+2.

What are the key properties of 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-(5-thiophen-2-ylpyrimidin-2-yl)-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-3-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(1-methylpyrrol-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+))?

2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-(5-thiophen-2-ylpyrimidin-2-yl)-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-3-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(1-methylpyrrol-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+)) has a molecular weight of 4300.44 g/mol, XLogP of 40.17, 40 rotatable bonds, 0 hydrogen bond donors, and 40 hydrogen bond acceptors.

Where does this data come from?

All data for 2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-9-(5-thiophen-2-ylpyrimidin-2-yl)-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(furan-3-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[5-(1-methylpyrrol-2-yl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;octakis(platinum(2+)) is sourced from PubChem (CID 158788138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).