bis(2-(3H-indol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);2-phenanthridin-6-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;tetrakis(platinum(2+));2-pyrazol-1-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide

C156H103N17Pt4 — CID 163683948

About bis(2-(3H-indol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);2-phenanthridin-6-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;tetrakis(platinum(2+));2-pyrazol-1-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide

bis(2-(3H-indol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);2-phenanthridin-6-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;tetrakis(platinum(2+));2-pyrazol-1-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide (PubChem CID 163683948) has the molecular formula C156H103N17Pt4 and a molecular weight of 2995.97 g/mol. Its IUPAC name is bis(2-(3H-indol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);2-phenanthridin-6-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;tetrakis(platinum(2+));2-pyrazol-1-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide.

Molecular Properties

• Compound Name: bis(2-(3H-indol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);2-phenanthridin-6-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;tetrakis(platinum(2+));2-pyrazol-1-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide
• PubChem CID: 163683948
• Molecular Formula: C156H103N17Pt4
• Molecular Weight: 2995.97 g/mol
• Exact Mass: 2993.72
• IUPAC Name: bis(2-(3H-indol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);2-phenanthridin-6-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;tetrakis(platinum(2+));2-pyrazol-1-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide
• SMILES: [Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(-c2nc3ccccc3c3ccccc23)ccc2c1N(c1[c-]c3c(cc1)c1ccccc1n3-c1ccccn1)c1ccccc1CC2.[c-]1c(-n2cccn2)ccc2c1N(c1[c-]c3c(cc1)c1ccccc1n3-c1ccccn1)c1ccccc1CC2.[c-]1c(C2=Nc3ccccc3C2)ccc2c1N(c1[c-]c3c(cc1)c1ccccc1n3-c1ccccn1)c1ccccc1CC2.[c-]1c(C2=Nc3ccccc3C2)ccc2c1N(c1[c-]c3c(cc1)c1ccccc1n3-c1ccccn1)c1ccccc1CC2
• InChI: InChI=1S/C44H28N4.2C39H26N4.C34H23N5.4Pt/c1-7-17-39-29(11-1)20-21-30-22-23-31(44-37-15-3-2-12-33(37)34-13-4-6-16-38(34)46-44)27-41(30)47(39)32-24-25-36-35-14-5-8-18-40(35)48(42(36)28-32)43-19-9-10-26-45-43;2*1-4-12-33-28(10-1)23-34(41-33)29-19-18-27-17-16-26-9-2-5-13-35(26)42(37(27)24-29)30-20-21-32-31-11-3-6-14-36(31)43(38(32)25-30)39-15-7-8-22-40-39;1-3-10-30-24(8-1)13-14-25-15-16-26(37-21-7-20-36-37)22-32(25)38(30)27-17-18-29-28-9-2-4-11-31(28)39(33(29)23-27)34-12-5-6-19-35-34;;;;/h1-19,22-26H,20-21H2;2*1-15,18-22H,16-17,23H2;1-12,15-21H,13-14H2;;;;/q4*-2;4*+2
• InChIKey: RGNRNWYFUHUPBG-UHFFFAOYSA-N
• XLogP: 36.29
• TPSA: 139.67 Ų
• H-Bond Acceptors: 17
• Rotatable Bonds: 12
• Heavy Atoms: 177
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2995.97
LogP ≤ 5	36.29
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of bis(2-(3H-indol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);2-phenanthridin-6-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;tetrakis(platinum(2+));2-pyrazol-1-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide?

The IUPAC name of bis(2-(3H-indol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);2-phenanthridin-6-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;tetrakis(platinum(2+));2-pyrazol-1-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide (CID 163683948) is bis(2-(3H-indol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);2-phenanthridin-6-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;tetrakis(platinum(2+));2-pyrazol-1-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide.

What is the SMILES notation for bis(2-(3H-indol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);2-phenanthridin-6-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;tetrakis(platinum(2+));2-pyrazol-1-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide?

The canonical SMILES for bis(2-(3H-indol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);2-phenanthridin-6-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;tetrakis(platinum(2+));2-pyrazol-1-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide is [Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(-c2nc3ccccc3c3ccccc23)ccc2c1N(c1[c-]c3c(cc1)c1ccccc1n3-c1ccccn1)c1ccccc1CC2.[c-]1c(-n2cccn2)ccc2c1N(c1[c-]c3c(cc1)c1ccccc1n3-c1ccccn1)c1ccccc1CC2.[c-]1c(C2=Nc3ccccc3C2)ccc2c1N(c1[c-]c3c(cc1)c1ccccc1n3-c1ccccn1)c1ccccc1CC2.[c-]1c(C2=Nc3ccccc3C2)ccc2c1N(c1[c-]c3c(cc1)c1ccccc1n3-c1ccccn1)c1ccccc1CC2.

What is the InChIKey of bis(2-(3H-indol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);2-phenanthridin-6-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;tetrakis(platinum(2+));2-pyrazol-1-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide?

The InChIKey is RGNRNWYFUHUPBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H28N4.2C39H26N4.C34H23N5.4Pt/c1-7-17-39-29(11-1)20-21-30-22-23-31(44-37-15-3-2-12-33(37)34-13-4-6-16-38(34)46-44)27-41(30)47(39)32-24-25-36-35-14-5-8-18-40(35)48(42(36)28-32)43-19-9-10-26-45-43;2*1-4-12-33-28(10-1)23-34(41-33)29-19-18-27-17-16-26-9-2-5-13-35(26)42(37(27)24-29)30-20-21-32-31-11-3-6-14-36(31)43(38(32)25-30)39-15-7-8-22-40-39;1-3-10-30-24(8-1)13-14-25-15-16-26(37-21-7-20-36-37)22-32(25)38(30)27-17-18-29-28-9-2-4-11-31(28)39(33(29)23-27)34-12-5-6-19-35-34;;;;/h1-19,22-26H,20-21H2;2*1-15,18-22H,16-17,23H2;1-12,15-21H,13-14H2;;;;/q4*-2;4*+2.

What are the key properties of bis(2-(3H-indol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);2-phenanthridin-6-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;tetrakis(platinum(2+));2-pyrazol-1-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide?

bis(2-(3H-indol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);2-phenanthridin-6-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;tetrakis(platinum(2+));2-pyrazol-1-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide has a molecular weight of 2995.97 g/mol, XLogP of 36.29, 12 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for bis(2-(3H-indol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);2-phenanthridin-6-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;tetrakis(platinum(2+));2-pyrazol-1-yl-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide is sourced from PubChem (CID 163683948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).