2,7-bis[(9-methyl-2-pyrazol-1-yl-3H-carbazol-3-id-4-yl)oxy]-5,10-dipyridin-2-yl-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+))

C56H34N10O2Pt2 — CID 154592405

About 2,7-bis[(9-methyl-2-pyrazol-1-yl-3H-carbazol-3-id-4-yl)oxy]-5,10-dipyridin-2-yl-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+))

2,7-bis[(9-methyl-2-pyrazol-1-yl-3H-carbazol-3-id-4-yl)oxy]-5,10-dipyridin-2-yl-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+)) (PubChem CID 154592405) has the molecular formula C56H34N10O2Pt2 and a molecular weight of 1269.11 g/mol. Its IUPAC name is 2,7-bis[(9-methyl-2-pyrazol-1-yl-3H-carbazol-3-id-4-yl)oxy]-5,10-dipyridin-2-yl-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+)).

Molecular Properties

• Compound Name: 2,7-bis[(9-methyl-2-pyrazol-1-yl-3H-carbazol-3-id-4-yl)oxy]-5,10-dipyridin-2-yl-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+))
• PubChem CID: 154592405
• Molecular Formula: C56H34N10O2Pt2
• Molecular Weight: 1269.11 g/mol
• Exact Mass: 1268.22
• IUPAC Name: 2,7-bis[(9-methyl-2-pyrazol-1-yl-3H-carbazol-3-id-4-yl)oxy]-5,10-dipyridin-2-yl-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+))
• SMILES: Cn1c2ccccc2c2c(Oc3[c-]c4c(cc3)c3c(c5ccc(Oc6[c-]c(-n7cccn7)cc7c6c6ccccc6n7C)[c-]c5n3-c3ccccn3)n4-c3ccccn3)[c-]c(-n3cccn3)cc21.[Pt+2].[Pt+2]
• InChI: InChI=1S/C56H34N10O2.2Pt/c1-61-43-15-5-3-13-39(43)53-47(61)29-35(63-27-11-25-59-63)31-49(53)67-37-19-21-41-45(33-37)65(51-17-7-9-23-57-51)56-42-22-20-38(34-46(42)66(55(41)56)52-18-8-10-24-58-52)68-50-32-36(64-28-12-26-60-64)30-48-54(50)40-14-4-6-16-44(40)62(48)2;;/h3-30H,1-2H3;;/q-4;2*+2
• InChIKey: IREZJZVTEOZDST-UHFFFAOYSA-N
• XLogP: 11.96
• TPSA: 99.60 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 8
• Heavy Atoms: 70
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1269.11
LogP ≤ 5	11.96
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

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[(9-methyl-2-pyrazol-1-yl-3H-carbazol-3-id-4-yl)oxy]-5,10-dipyridin-2-yl-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+))?

The IUPAC name of 2,7-bis[(9-methyl-2-pyrazol-1-yl-3H-carbazol-3-id-4-yl)oxy]-5,10-dipyridin-2-yl-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+)) (CID 154592405) is 2,7-bis[(9-methyl-2-pyrazol-1-yl-3H-carbazol-3-id-4-yl)oxy]-5,10-dipyridin-2-yl-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+)).

What is the SMILES notation for 2,7-bis[(9-methyl-2-pyrazol-1-yl-3H-carbazol-3-id-4-yl)oxy]-5,10-dipyridin-2-yl-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+))?

The canonical SMILES for 2,7-bis[(9-methyl-2-pyrazol-1-yl-3H-carbazol-3-id-4-yl)oxy]-5,10-dipyridin-2-yl-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+)) is Cn1c2ccccc2c2c(Oc3[c-]c4c(cc3)c3c(c5ccc(Oc6[c-]c(-n7cccn7)cc7c6c6ccccc6n7C)[c-]c5n3-c3ccccn3)n4-c3ccccn3)[c-]c(-n3cccn3)cc21.[Pt+2].[Pt+2].

What is the InChIKey of 2,7-bis[(9-methyl-2-pyrazol-1-yl-3H-carbazol-3-id-4-yl)oxy]-5,10-dipyridin-2-yl-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+))?

The InChIKey is IREZJZVTEOZDST-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H34N10O2.2Pt/c1-61-43-15-5-3-13-39(43)53-47(61)29-35(63-27-11-25-59-63)31-49(53)67-37-19-21-41-45(33-37)65(51-17-7-9-23-57-51)56-42-22-20-38(34-46(42)66(55(41)56)52-18-8-10-24-58-52)68-50-32-36(64-28-12-26-60-64)30-48-54(50)40-14-4-6-16-44(40)62(48)2;;/h3-30H,1-2H3;;/q-4;2*+2.

What are the key properties of 2,7-bis[(9-methyl-2-pyrazol-1-yl-3H-carbazol-3-id-4-yl)oxy]-5,10-dipyridin-2-yl-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+))?

2,7-bis[(9-methyl-2-pyrazol-1-yl-3H-carbazol-3-id-4-yl)oxy]-5,10-dipyridin-2-yl-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+)) has a molecular weight of 1269.11 g/mol, XLogP of 11.96, 8 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 2,7-bis[(9-methyl-2-pyrazol-1-yl-3H-carbazol-3-id-4-yl)oxy]-5,10-dipyridin-2-yl-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+)) is sourced from PubChem (CID 154592405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).