2-(3,5-dimethylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(1-methylimidazol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(4-phenylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-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)-1H-benzo[b][1]benzazepin-1-ide

C145H94N20Pt4 — CID 159248902

About 2-(3,5-dimethylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(1-methylimidazol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(4-phenylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-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)-1H-benzo[b][1]benzazepin-1-ide

2-(3,5-dimethylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(1-methylimidazol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(4-phenylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-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)-1H-benzo[b][1]benzazepin-1-ide (PubChem CID 159248902) has the molecular formula C145H94N20Pt4 and a molecular weight of 2896.80 g/mol. Its IUPAC name is 2-(3,5-dimethylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(1-methylimidazol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(4-phenylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-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)-1H-benzo[b][1]benzazepin-1-ide.

Molecular Properties

• Compound Name: 2-(3,5-dimethylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(1-methylimidazol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(4-phenylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-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)-1H-benzo[b][1]benzazepin-1-ide
• PubChem CID: 159248902
• Molecular Formula: C145H94N20Pt4
• Molecular Weight: 2896.80 g/mol
• Exact Mass: 2894.66
• IUPAC Name: 2-(3,5-dimethylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(1-methylimidazol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(4-phenylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-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)-1H-benzo[b][1]benzazepin-1-ide
• SMILES: Cc1cc(C)n(-c2[c-]c3c(cc2)C=Cc2ccccc2N3c2[c-]c3c(cc2)c2ccccc2n3-c2ccccn2)n1.Cn1ccnc1-c1[c-]c2c(cc1)C=Cc1ccccc1N2c1[c-]c2c(cc1)c1ccccc1n2-c1ccccn1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(-n2cc(-c3ccccc3)cn2)ccc2c1N(c1[c-]c3c(cc1)c1ccccc1n3-c1ccccn1)c1ccccc1C=C2.[c-]1c(-n2cccn2)ccc2c1N(c1[c-]c3c(cc1)c1ccccc1n3-c1ccccn1)c1ccccc1C=C2
• InChI: InChI=1S/C40H25N5.C36H25N5.C35H23N5.C34H21N5.4Pt/c1-2-10-28(11-3-1)31-26-42-43(27-31)32-20-19-30-18-17-29-12-4-6-14-36(29)44(38(30)24-32)33-21-22-35-34-13-5-7-15-37(34)45(39(35)25-33)40-16-8-9-23-41-40;1-24-21-25(2)41(38-24)29-17-16-27-15-14-26-9-3-5-11-32(26)39(34(27)23-29)28-18-19-31-30-10-4-6-12-33(30)40(35(31)22-28)36-13-7-8-20-37-36;1-38-21-20-37-35(38)26-16-15-25-14-13-24-8-2-4-10-30(24)39(32(25)22-26)27-17-18-29-28-9-3-5-11-31(28)40(33(29)23-27)34-12-6-7-19-36-34;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;;;;/h1-23,26-27H;3-21H,1-2H3;2-21H,1H3;1-21H;;;;/q4*-2;4*+2
• InChIKey: RRAXCUJRSHWZHK-UHFFFAOYSA-N
• XLogP: 34.16
• TPSA: 155.52 Ų
• H-Bond Acceptors: 20
• Rotatable Bonds: 13
• Heavy Atoms: 169
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2896.80
LogP ≤ 5	34.16
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(1-methylimidazol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(4-phenylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-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)-1H-benzo[b][1]benzazepin-1-ide?

The IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(1-methylimidazol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(4-phenylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-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)-1H-benzo[b][1]benzazepin-1-ide (CID 159248902) is 2-(3,5-dimethylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(1-methylimidazol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(4-phenylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-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)-1H-benzo[b][1]benzazepin-1-ide.

What is the SMILES notation for 2-(3,5-dimethylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(1-methylimidazol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(4-phenylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-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)-1H-benzo[b][1]benzazepin-1-ide?

The canonical SMILES for 2-(3,5-dimethylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(1-methylimidazol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(4-phenylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-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)-1H-benzo[b][1]benzazepin-1-ide is Cc1cc(C)n(-c2[c-]c3c(cc2)C=Cc2ccccc2N3c2[c-]c3c(cc2)c2ccccc2n3-c2ccccn2)n1.Cn1ccnc1-c1[c-]c2c(cc1)C=Cc1ccccc1N2c1[c-]c2c(cc1)c1ccccc1n2-c1ccccn1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(-n2cc(-c3ccccc3)cn2)ccc2c1N(c1[c-]c3c(cc1)c1ccccc1n3-c1ccccn1)c1ccccc1C=C2.[c-]1c(-n2cccn2)ccc2c1N(c1[c-]c3c(cc1)c1ccccc1n3-c1ccccn1)c1ccccc1C=C2.

What is the InChIKey of 2-(3,5-dimethylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(1-methylimidazol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(4-phenylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-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)-1H-benzo[b][1]benzazepin-1-ide?

The InChIKey is RRAXCUJRSHWZHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H25N5.C36H25N5.C35H23N5.C34H21N5.4Pt/c1-2-10-28(11-3-1)31-26-42-43(27-31)32-20-19-30-18-17-29-12-4-6-14-36(29)44(38(30)24-32)33-21-22-35-34-13-5-7-15-37(34)45(39(35)25-33)40-16-8-9-23-41-40;1-24-21-25(2)41(38-24)29-17-16-27-15-14-26-9-3-5-11-32(26)39(34(27)23-29)28-18-19-31-30-10-4-6-12-33(30)40(35(31)22-28)36-13-7-8-20-37-36;1-38-21-20-37-35(38)26-16-15-25-14-13-24-8-2-4-10-30(24)39(32(25)22-26)27-17-18-29-28-9-3-5-11-31(28)40(33(29)23-27)34-12-6-7-19-36-34;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;;;;/h1-23,26-27H;3-21H,1-2H3;2-21H,1H3;1-21H;;;;/q4*-2;4*+2.

What are the key properties of 2-(3,5-dimethylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(1-methylimidazol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(4-phenylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-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)-1H-benzo[b][1]benzazepin-1-ide?

2-(3,5-dimethylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(1-methylimidazol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(4-phenylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-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)-1H-benzo[b][1]benzazepin-1-ide has a molecular weight of 2896.80 g/mol, XLogP of 34.16, 13 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(3,5-dimethylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(1-methylimidazol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(4-phenylpyrazol-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-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)-1H-benzo[b][1]benzazepin-1-ide is sourced from PubChem (CID 159248902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).