5,10-dipyridin-2-yl-2,7-bis[[3-(1,4,5-trimethylimidazol-2-yl)benzene-2-id-1-yl]oxy]-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+))

C48H36N8O2Pt2 — CID 154592374

IUPAC5,10-dipyridin-2-yl-2,7-bis[[3-(1,4,5-trimethylimidazol-2-yl)benzene-2-id-1-yl]oxy]-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+))
SMILESCc1nc(-c2[c-]c(Oc3[c-]c4c(cc3)c3c(c5ccc(Oc6[c-]c(-c7nc(C)c(C)n7C)ccc6)[c-]c5n3-c3ccccn3)n4-c3ccccn3)ccc2)n(C)c1C.[Pt+2].[Pt+2]
InChIInChI=1S/C48H36N8O2.2Pt/c1-29-31(3)53(5)47(51-29)33-13-11-15-35(25-33)57-37-19-21-39-41(27-37)55(43-17-7-9-23-49-43)46-40-22-20-38(28-42(40)56(45(39)46)44-18-8-10-24-50-44)58-36-16-12-14-34(26-36)48-52-30(2)32(4)54(48)6;;/h7-24H,1-6H3;;/q-4;2*+2
InChIKeyDLDZXXMWUBDEOI-UHFFFAOYSA-N
MW1147.03 g/mol
LogP10.33
Rot. Bonds8

About 5,10-dipyridin-2-yl-2,7-bis[[3-(1,4,5-trimethylimidazol-2-yl)benzene-2-id-1-yl]oxy]-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+))

5,10-dipyridin-2-yl-2,7-bis[[3-(1,4,5-trimethylimidazol-2-yl)benzene-2-id-1-yl]oxy]-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+)) (PubChem CID 154592374) has the molecular formula C48H36N8O2Pt2 and a molecular weight of 1147.03 g/mol. Its IUPAC name is 5,10-dipyridin-2-yl-2,7-bis[[3-(1,4,5-trimethylimidazol-2-yl)benzene-2-id-1-yl]oxy]-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+)).

Molecular Properties

Compound Name5,10-dipyridin-2-yl-2,7-bis[[3-(1,4,5-trimethylimidazol-2-yl)benzene-2-id-1-yl]oxy]-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+))
PubChem CID154592374
Molecular FormulaC48H36N8O2Pt2
Molecular Weight1147.03 g/mol
Exact Mass1146.23
IUPAC Name5,10-dipyridin-2-yl-2,7-bis[[3-(1,4,5-trimethylimidazol-2-yl)benzene-2-id-1-yl]oxy]-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+))
SMILESCc1nc(-c2[c-]c(Oc3[c-]c4c(cc3)c3c(c5ccc(Oc6[c-]c(-c7nc(C)c(C)n7C)ccc6)[c-]c5n3-c3ccccn3)n4-c3ccccn3)ccc2)n(C)c1C.[Pt+2].[Pt+2]
InChIInChI=1S/C48H36N8O2.2Pt/c1-29-31(3)53(5)47(51-29)33-13-11-15-35(25-33)57-37-19-21-39-41(27-37)55(43-17-7-9-23-49-43)46-40-22-20-38(28-42(40)56(45(39)46)44-18-8-10-24-50-44)58-36-16-12-14-34(26-36)48-52-30(2)32(4)54(48)6;;/h7-24H,1-6H3;;/q-4;2*+2
InChIKeyDLDZXXMWUBDEOI-UHFFFAOYSA-N
XLogP10.33
TPSA89.74 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds8
Heavy Atoms60
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001147.03
LogP ≤ 510.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

Analyze 5,10-dipyridin-2-yl-2,7-bis[[3-(1,4,5-trimethylimidazol-2-yl)benzene-2-id-1-yl]oxy]-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+)) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5,10-dipyridin-2-yl-2,7-bis[[3-(1,4,5-trimethylimidazol-2-yl)benzene-2-id-1-yl]oxy]-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+))?
The IUPAC name of 5,10-dipyridin-2-yl-2,7-bis[[3-(1,4,5-trimethylimidazol-2-yl)benzene-2-id-1-yl]oxy]-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+)) (CID 154592374) is 5,10-dipyridin-2-yl-2,7-bis[[3-(1,4,5-trimethylimidazol-2-yl)benzene-2-id-1-yl]oxy]-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+)).
What is the SMILES notation for 5,10-dipyridin-2-yl-2,7-bis[[3-(1,4,5-trimethylimidazol-2-yl)benzene-2-id-1-yl]oxy]-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+))?
The canonical SMILES for 5,10-dipyridin-2-yl-2,7-bis[[3-(1,4,5-trimethylimidazol-2-yl)benzene-2-id-1-yl]oxy]-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+)) is Cc1nc(-c2[c-]c(Oc3[c-]c4c(cc3)c3c(c5ccc(Oc6[c-]c(-c7nc(C)c(C)n7C)ccc6)[c-]c5n3-c3ccccn3)n4-c3ccccn3)ccc2)n(C)c1C.[Pt+2].[Pt+2].
What is the InChIKey of 5,10-dipyridin-2-yl-2,7-bis[[3-(1,4,5-trimethylimidazol-2-yl)benzene-2-id-1-yl]oxy]-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+))?
The InChIKey is DLDZXXMWUBDEOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H36N8O2.2Pt/c1-29-31(3)53(5)47(51-29)33-13-11-15-35(25-33)57-37-19-21-39-41(27-37)55(43-17-7-9-23-49-43)46-40-22-20-38(28-42(40)56(45(39)46)44-18-8-10-24-50-44)58-36-16-12-14-34(26-36)48-52-30(2)32(4)54(48)6;;/h7-24H,1-6H3;;/q-4;2*+2.
What are the key properties of 5,10-dipyridin-2-yl-2,7-bis[[3-(1,4,5-trimethylimidazol-2-yl)benzene-2-id-1-yl]oxy]-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+))?
5,10-dipyridin-2-yl-2,7-bis[[3-(1,4,5-trimethylimidazol-2-yl)benzene-2-id-1-yl]oxy]-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+)) has a molecular weight of 1147.03 g/mol, XLogP of 10.33, 8 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 5,10-dipyridin-2-yl-2,7-bis[[3-(1,4,5-trimethylimidazol-2-yl)benzene-2-id-1-yl]oxy]-1,6-dihydroindolo[3,2-b]indole-1,6-diide;bis(platinum(2+)) is sourced from PubChem (CID 154592374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).