4-[3-[3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-10-methyl-4H-phenazin-4-id-5-yl]benzene-2-id-1-yl]-1,3-benzothiazole;2-indazol-1-yl-9-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;2-(1-methylbenzimidazol-1-ium-3-id-4-yl)-11-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum;tris(platinum(2+));10-(3-pyridin-2-ylbenzene-2-id-1-yl)-2-pyrrolo[2,3-b]pyridin-1-yl-1H-phenothiazin-1-ide;6-[3-(2-pyridin-2-yl-1H-carbazol-1-id-9-yl)benzene-2-id-1-yl]thieno[3,2-d][1,3]thiazole

C162H103N23Pt5S4-4 — CID 157188407

About 4-[3-[3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-10-methyl-4H-phenazin-4-id-5-yl]benzene-2-id-1-yl]-1,3-benzothiazole;2-indazol-1-yl-9-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;2-(1-methylbenzimidazol-1-ium-3-id-4-yl)-11-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum;tris(platinum(2+));10-(3-pyridin-2-ylbenzene-2-id-1-yl)-2-pyrrolo[2,3-b]pyridin-1-yl-1H-phenothiazin-1-ide;6-[3-(2-pyridin-2-yl-1H-carbazol-1-id-9-yl)benzene-2-id-1-yl]thieno[3,2-d][1,3]thiazole

4-[3-[3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-10-methyl-4H-phenazin-4-id-5-yl]benzene-2-id-1-yl]-1,3-benzothiazole;2-indazol-1-yl-9-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;2-(1-methylbenzimidazol-1-ium-3-id-4-yl)-11-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum;tris(platinum(2+));10-(3-pyridin-2-ylbenzene-2-id-1-yl)-2-pyrrolo[2,3-b]pyridin-1-yl-1H-phenothiazin-1-ide;6-[3-(2-pyridin-2-yl-1H-carbazol-1-id-9-yl)benzene-2-id-1-yl]thieno[3,2-d][1,3]thiazole (PubChem CID 157188407) has the molecular formula C162H103N23Pt5S4-4 and a molecular weight of 3475.42 g/mol. Its IUPAC name is 4-[3-[3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-10-methyl-4H-phenazin-4-id-5-yl]benzene-2-id-1-yl]-1,3-benzothiazole;2-indazol-1-yl-9-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;2-(1-methylbenzimidazol-1-ium-3-id-4-yl)-11-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum;tris(platinum(2+));10-(3-pyridin-2-ylbenzene-2-id-1-yl)-2-pyrrolo[2,3-b]pyridin-1-yl-1H-phenothiazin-1-ide;6-[3-(2-pyridin-2-yl-1H-carbazol-1-id-9-yl)benzene-2-id-1-yl]thieno[3,2-d][1,3]thiazole.

Molecular Properties

• Compound Name: 4-[3-[3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-10-methyl-4H-phenazin-4-id-5-yl]benzene-2-id-1-yl]-1,3-benzothiazole;2-indazol-1-yl-9-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;2-(1-methylbenzimidazol-1-ium-3-id-4-yl)-11-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum;tris(platinum(2+));10-(3-pyridin-2-ylbenzene-2-id-1-yl)-2-pyrrolo[2,3-b]pyridin-1-yl-1H-phenothiazin-1-ide;6-[3-(2-pyridin-2-yl-1H-carbazol-1-id-9-yl)benzene-2-id-1-yl]thieno[3,2-d][1,3]thiazole
• PubChem CID: 157188407
• Molecular Formula: C162H103N23Pt5S4-4
• Molecular Weight: 3475.42 g/mol
• Exact Mass: 3472.59
• IUPAC Name: 4-[3-[3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-10-methyl-4H-phenazin-4-id-5-yl]benzene-2-id-1-yl]-1,3-benzothiazole;2-indazol-1-yl-9-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;2-(1-methylbenzimidazol-1-ium-3-id-4-yl)-11-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum;tris(platinum(2+));10-(3-pyridin-2-ylbenzene-2-id-1-yl)-2-pyrrolo[2,3-b]pyridin-1-yl-1H-phenothiazin-1-ide;6-[3-(2-pyridin-2-yl-1H-carbazol-1-id-9-yl)benzene-2-id-1-yl]thieno[3,2-d][1,3]thiazole
• SMILES: CN1c2ccc(-c3cn(C)c4c3[n-]c[n+]4C)[c-]c2N(c2[c-]c(-c3cccc4scnc34)ccc2)c2ccccc21.C[n+]1c[n-]c2c(-c3[c-]c4c(cc3)CCc3ccccc3N4c3[c-]c(-n4c5ccccc5c5cccnc54)ccc3)cccc21.[Pt+2].[Pt+2].[Pt+2].[Pt].[Pt].[c-]1c(-c2ccccn2)cccc1N1c2[c-]c(-n3ccc4cccnc43)ccc2Sc2ccccc21.[c-]1c(-c2csc3scnc23)cccc1-n1c2[c-]c(-c3ccccn3)ccc2c2ccccc21.[c-]1c(-n2ccc3cccnc32)cccc1-n1c2[c-]c(-n3ncc4ccccc43)ccc2c2ccccc21
• InChI: InChI=1S/C39H27N5.C33H24N6S.C32H19N5.C30H18N4S.C28H15N3S2.5Pt/c1-42-25-41-38-31(13-7-17-36(38)42)28-21-20-27-19-18-26-9-2-4-15-34(26)43(37(27)23-28)29-10-6-11-30(24-29)44-35-16-5-3-12-32(35)33-14-8-22-40-39(33)44;1-36-18-25(32-33(36)37(2)19-34-32)22-14-15-27-29(17-22)39(28-12-5-4-11-26(28)38(27)3)23-9-6-8-21(16-23)24-10-7-13-30-31(24)35-20-40-30;1-3-12-29-23(7-1)21-34-37(29)26-14-15-28-27-11-2-4-13-30(27)36(31(28)20-26)25-10-5-9-24(19-25)35-18-16-22-8-6-17-33-32(22)35;1-2-12-28-26(11-1)34(24-9-5-7-22(19-24)25-10-3-4-16-31-25)27-20-23(13-14-29(27)35-28)33-18-15-21-8-6-17-32-30(21)33;1-2-10-25-21(8-1)22-12-11-19(24-9-3-4-13-29-24)15-26(22)31(25)20-7-5-6-18(14-20)23-16-32-28-27(23)30-17-33-28;;;;;/h2-17,20-22,25H,18-19H2,1H3;4-15,18-20H,1-3H3;1-18,21H;1-18H;1-13,16-17H;;;;;/q5*-2;;;3*+2
• InChIKey: XGHUHNXSFJMSKI-UHFFFAOYSA-N
• XLogP: 37.46
• TPSA: 186.55 Ų
• H-Bond Acceptors: 23
• Rotatable Bonds: 15
• Heavy Atoms: 194
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3475.42
LogP ≤ 5	37.46
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

• Structural Alerts: {'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 4-[3-[3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-10-methyl-4H-phenazin-4-id-5-yl]benzene-2-id-1-yl]-1,3-benzothiazole;2-indazol-1-yl-9-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;2-(1-methylbenzimidazol-1-ium-3-id-4-yl)-11-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum;tris(platinum(2+));10-(3-pyridin-2-ylbenzene-2-id-1-yl)-2-pyrrolo[2,3-b]pyridin-1-yl-1H-phenothiazin-1-ide;6-[3-(2-pyridin-2-yl-1H-carbazol-1-id-9-yl)benzene-2-id-1-yl]thieno[3,2-d][1,3]thiazole?

The IUPAC name of 4-[3-[3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-10-methyl-4H-phenazin-4-id-5-yl]benzene-2-id-1-yl]-1,3-benzothiazole;2-indazol-1-yl-9-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;2-(1-methylbenzimidazol-1-ium-3-id-4-yl)-11-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum;tris(platinum(2+));10-(3-pyridin-2-ylbenzene-2-id-1-yl)-2-pyrrolo[2,3-b]pyridin-1-yl-1H-phenothiazin-1-ide;6-[3-(2-pyridin-2-yl-1H-carbazol-1-id-9-yl)benzene-2-id-1-yl]thieno[3,2-d][1,3]thiazole (CID 157188407) is 4-[3-[3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-10-methyl-4H-phenazin-4-id-5-yl]benzene-2-id-1-yl]-1,3-benzothiazole;2-indazol-1-yl-9-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;2-(1-methylbenzimidazol-1-ium-3-id-4-yl)-11-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum;tris(platinum(2+));10-(3-pyridin-2-ylbenzene-2-id-1-yl)-2-pyrrolo[2,3-b]pyridin-1-yl-1H-phenothiazin-1-ide;6-[3-(2-pyridin-2-yl-1H-carbazol-1-id-9-yl)benzene-2-id-1-yl]thieno[3,2-d][1,3]thiazole.

What is the SMILES notation for 4-[3-[3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-10-methyl-4H-phenazin-4-id-5-yl]benzene-2-id-1-yl]-1,3-benzothiazole;2-indazol-1-yl-9-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;2-(1-methylbenzimidazol-1-ium-3-id-4-yl)-11-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum;tris(platinum(2+));10-(3-pyridin-2-ylbenzene-2-id-1-yl)-2-pyrrolo[2,3-b]pyridin-1-yl-1H-phenothiazin-1-ide;6-[3-(2-pyridin-2-yl-1H-carbazol-1-id-9-yl)benzene-2-id-1-yl]thieno[3,2-d][1,3]thiazole?

The canonical SMILES for 4-[3-[3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-10-methyl-4H-phenazin-4-id-5-yl]benzene-2-id-1-yl]-1,3-benzothiazole;2-indazol-1-yl-9-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;2-(1-methylbenzimidazol-1-ium-3-id-4-yl)-11-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum;tris(platinum(2+));10-(3-pyridin-2-ylbenzene-2-id-1-yl)-2-pyrrolo[2,3-b]pyridin-1-yl-1H-phenothiazin-1-ide;6-[3-(2-pyridin-2-yl-1H-carbazol-1-id-9-yl)benzene-2-id-1-yl]thieno[3,2-d][1,3]thiazole is CN1c2ccc(-c3cn(C)c4c3[n-]c[n+]4C)[c-]c2N(c2[c-]c(-c3cccc4scnc34)ccc2)c2ccccc21.C[n+]1c[n-]c2c(-c3[c-]c4c(cc3)CCc3ccccc3N4c3[c-]c(-n4c5ccccc5c5cccnc54)ccc3)cccc21.[Pt+2].[Pt+2].[Pt+2].[Pt].[Pt].[c-]1c(-c2ccccn2)cccc1N1c2[c-]c(-n3ccc4cccnc43)ccc2Sc2ccccc21.[c-]1c(-c2csc3scnc23)cccc1-n1c2[c-]c(-c3ccccn3)ccc2c2ccccc21.[c-]1c(-n2ccc3cccnc32)cccc1-n1c2[c-]c(-n3ncc4ccccc43)ccc2c2ccccc21.

What is the InChIKey of 4-[3-[3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-10-methyl-4H-phenazin-4-id-5-yl]benzene-2-id-1-yl]-1,3-benzothiazole;2-indazol-1-yl-9-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;2-(1-methylbenzimidazol-1-ium-3-id-4-yl)-11-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum;tris(platinum(2+));10-(3-pyridin-2-ylbenzene-2-id-1-yl)-2-pyrrolo[2,3-b]pyridin-1-yl-1H-phenothiazin-1-ide;6-[3-(2-pyridin-2-yl-1H-carbazol-1-id-9-yl)benzene-2-id-1-yl]thieno[3,2-d][1,3]thiazole?

The InChIKey is XGHUHNXSFJMSKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H27N5.C33H24N6S.C32H19N5.C30H18N4S.C28H15N3S2.5Pt/c1-42-25-41-38-31(13-7-17-36(38)42)28-21-20-27-19-18-26-9-2-4-15-34(26)43(37(27)23-28)29-10-6-11-30(24-29)44-35-16-5-3-12-32(35)33-14-8-22-40-39(33)44;1-36-18-25(32-33(36)37(2)19-34-32)22-14-15-27-29(17-22)39(28-12-5-4-11-26(28)38(27)3)23-9-6-8-21(16-23)24-10-7-13-30-31(24)35-20-40-30;1-3-12-29-23(7-1)21-34-37(29)26-14-15-28-27-11-2-4-13-30(27)36(31(28)20-26)25-10-5-9-24(19-25)35-18-16-22-8-6-17-33-32(22)35;1-2-12-28-26(11-1)34(24-9-5-7-22(19-24)25-10-3-4-16-31-25)27-20-23(13-14-29(27)35-28)33-18-15-21-8-6-17-32-30(21)33;1-2-10-25-21(8-1)22-12-11-19(24-9-3-4-13-29-24)15-26(22)31(25)20-7-5-6-18(14-20)23-16-32-28-27(23)30-17-33-28;;;;;/h2-17,20-22,25H,18-19H2,1H3;4-15,18-20H,1-3H3;1-18,21H;1-18H;1-13,16-17H;;;;;/q5*-2;;;3*+2.

What are the key properties of 4-[3-[3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-10-methyl-4H-phenazin-4-id-5-yl]benzene-2-id-1-yl]-1,3-benzothiazole;2-indazol-1-yl-9-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;2-(1-methylbenzimidazol-1-ium-3-id-4-yl)-11-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum;tris(platinum(2+));10-(3-pyridin-2-ylbenzene-2-id-1-yl)-2-pyrrolo[2,3-b]pyridin-1-yl-1H-phenothiazin-1-ide;6-[3-(2-pyridin-2-yl-1H-carbazol-1-id-9-yl)benzene-2-id-1-yl]thieno[3,2-d][1,3]thiazole?

4-[3-[3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-10-methyl-4H-phenazin-4-id-5-yl]benzene-2-id-1-yl]-1,3-benzothiazole;2-indazol-1-yl-9-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;2-(1-methylbenzimidazol-1-ium-3-id-4-yl)-11-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum;tris(platinum(2+));10-(3-pyridin-2-ylbenzene-2-id-1-yl)-2-pyrrolo[2,3-b]pyridin-1-yl-1H-phenothiazin-1-ide;6-[3-(2-pyridin-2-yl-1H-carbazol-1-id-9-yl)benzene-2-id-1-yl]thieno[3,2-d][1,3]thiazole has a molecular weight of 3475.42 g/mol, XLogP of 37.46, 15 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[3-[3-(3,4-dimethylpyrrolo[2,3-d]imidazol-3-ium-1-id-6-yl)-10-methyl-4H-phenazin-4-id-5-yl]benzene-2-id-1-yl]-1,3-benzothiazole;2-indazol-1-yl-9-(3-pyrrolo[2,3-b]pyridin-1-ylbenzene-2-id-1-yl)-1H-carbazol-1-ide;2-(1-methylbenzimidazol-1-ium-3-id-4-yl)-11-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum;tris(platinum(2+));10-(3-pyridin-2-ylbenzene-2-id-1-yl)-2-pyrrolo[2,3-b]pyridin-1-yl-1H-phenothiazin-1-ide;6-[3-(2-pyridin-2-yl-1H-carbazol-1-id-9-yl)benzene-2-id-1-yl]thieno[3,2-d][1,3]thiazole is sourced from PubChem (CID 157188407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).