2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-9-[5-(trideuteriomethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-(4,5-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(4,6-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-methylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-5-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-6-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;hexakis(palladium(2+));hexakis(platinum(2+))

C238H146N30O12Pd6Pt6 — CID 158630605

IUPAC2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-9-[5-(trideuteriomethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-(4,5-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(4,6-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-methylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-5-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-6-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;hexakis(palladium(2+));hexakis(platinum(2+))
SMILESCc1cc(C)nc(-n2c3[c-]c(Oc4[c-]c(-c5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(-c5ccccn5)ccc4)[c-]c32)n1.Cc1cnc(-n2c3[c-]c(Oc4[c-]c(-c5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(-c5ccccn5)ccc4)[c-]c32)nc1.Cc1cnc(-n2c3[c-]c(Oc4[c-]c(-c5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(-c5ccccn5)ccc4)[c-]c32)nc1C.[2H]C([2H])([2H])c1cc(C)nc(-n2c3[c-]c(Oc4[c-]c(-c5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(-c5ccccn5)ccc4)[c-]c32)n1.[2H]C([2H])([2H])c1cnc(-n2c3[c-]c(Oc4[c-]c(-c5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(-c5ccccn5)ccc4)[c-]c32)nc1.[2H]C([2H])([2H])c1cnc(-n2c3[c-]c(Oc4[c-]c(-c5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(-c5ccccn5)ccc4)[c-]c32)nc1C.[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/4C40H25N5O2.2C39H23N5O2.6Pd.6Pt/c2*1-26-25-43-40(44-27(26)2)45-38-23-32(46-30-11-7-9-28(21-30)36-13-3-5-19-41-36)15-17-34(38)35-18-16-33(24-39(35)45)47-31-12-8-10-29(22-31)37-14-4-6-20-42-37;2*1-26-21-27(2)44-40(43-26)45-38-24-32(46-30-11-7-9-28(22-30)36-13-3-5-19-41-36)15-17-34(38)35-18-16-33(25-39(35)45)47-31-12-8-10-29(23-31)37-14-4-6-20-42-37;2*1-26-24-42-39(43-25-26)44-37-22-31(45-29-10-6-8-27(20-29)35-12-2-4-18-40-35)14-16-33(37)34-17-15-32(23-38(34)44)46-30-11-7-9-28(21-30)36-13-3-5-19-41-36;;;;;;;;;;;;/h2*3-20,25H,1-2H3;2*3-21H,1-2H3;2*2-19,24-25H,1H3;;;;;;;;;;;;/q6*-4;12*+2/i1D3;;1D3;;1D3;;;;;;;;;;;;;
InChIKeyUCIZALBZIHQXPW-HLSJMNPOSA-N
MW5436.03 g/mol
LogP53.95
Rot. Bonds45

About 2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-9-[5-(trideuteriomethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-(4,5-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(4,6-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-methylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-5-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-6-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;hexakis(palladium(2+));hexakis(platinum(2+))

2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-9-[5-(trideuteriomethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-(4,5-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(4,6-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-methylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-5-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-6-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;hexakis(palladium(2+));hexakis(platinum(2+)) (PubChem CID 158630605) has the molecular formula C238H146N30O12Pd6Pt6 and a molecular weight of 5436.03 g/mol. Its IUPAC name is 2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-9-[5-(trideuteriomethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-(4,5-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(4,6-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-methylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-5-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-6-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;hexakis(palladium(2+));hexakis(platinum(2+)).

Molecular Properties

Compound Name2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-9-[5-(trideuteriomethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-(4,5-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(4,6-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-methylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-5-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-6-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;hexakis(palladium(2+));hexakis(platinum(2+))
PubChem CID158630605
Molecular FormulaC238H146N30O12Pd6Pt6
Molecular Weight5436.03 g/mol
Exact Mass5429.44
IUPAC Name2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-9-[5-(trideuteriomethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-(4,5-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(4,6-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-methylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-5-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-6-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;hexakis(palladium(2+));hexakis(platinum(2+))
SMILESCc1cc(C)nc(-n2c3[c-]c(Oc4[c-]c(-c5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(-c5ccccn5)ccc4)[c-]c32)n1.Cc1cnc(-n2c3[c-]c(Oc4[c-]c(-c5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(-c5ccccn5)ccc4)[c-]c32)nc1.Cc1cnc(-n2c3[c-]c(Oc4[c-]c(-c5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(-c5ccccn5)ccc4)[c-]c32)nc1C.[2H]C([2H])([2H])c1cc(C)nc(-n2c3[c-]c(Oc4[c-]c(-c5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(-c5ccccn5)ccc4)[c-]c32)n1.[2H]C([2H])([2H])c1cnc(-n2c3[c-]c(Oc4[c-]c(-c5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(-c5ccccn5)ccc4)[c-]c32)nc1.[2H]C([2H])([2H])c1cnc(-n2c3[c-]c(Oc4[c-]c(-c5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(-c5ccccn5)ccc4)[c-]c32)nc1C.[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/4C40H25N5O2.2C39H23N5O2.6Pd.6Pt/c2*1-26-25-43-40(44-27(26)2)45-38-23-32(46-30-11-7-9-28(21-30)36-13-3-5-19-41-36)15-17-34(38)35-18-16-33(24-39(35)45)47-31-12-8-10-29(22-31)37-14-4-6-20-42-37;2*1-26-21-27(2)44-40(43-26)45-38-24-32(46-30-11-7-9-28(22-30)36-13-3-5-19-41-36)15-17-34(38)35-18-16-33(25-39(35)45)47-31-12-8-10-29(23-31)37-14-4-6-20-42-37;2*1-26-24-42-39(43-25-26)44-37-22-31(45-29-10-6-8-27(20-29)35-12-2-4-18-40-35)14-16-33(37)34-17-15-32(23-38(34)44)46-30-11-7-9-28(21-30)36-13-3-5-19-41-36;;;;;;;;;;;;/h2*3-20,25H,1-2H3;2*3-21H,1-2H3;2*2-19,24-25H,1H3;;;;;;;;;;;;/q6*-4;12*+2/i1D3;;1D3;;1D3;;;;;;;;;;;;;
InChIKeyUCIZALBZIHQXPW-HLSJMNPOSA-N
XLogP53.95
TPSA449.70 Ų
H-Bond Donors
H-Bond Acceptors42
Rotatable Bonds45
Heavy Atoms292
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005436.03
LogP ≤ 553.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1042

Analyze 2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-9-[5-(trideuteriomethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-(4,5-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(4,6-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-methylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-5-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-6-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;hexakis(palladium(2+));hexakis(platinum(2+)) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-9-[5-(trideuteriomethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-(4,5-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(4,6-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-methylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-5-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-6-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;hexakis(palladium(2+));hexakis(platinum(2+))?
The IUPAC name of 2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-9-[5-(trideuteriomethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-(4,5-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(4,6-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-methylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-5-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-6-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;hexakis(palladium(2+));hexakis(platinum(2+)) (CID 158630605) is 2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-9-[5-(trideuteriomethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-(4,5-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(4,6-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-methylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-5-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-6-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;hexakis(palladium(2+));hexakis(platinum(2+)).
What is the SMILES notation for 2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-9-[5-(trideuteriomethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-(4,5-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(4,6-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-methylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-5-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-6-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;hexakis(palladium(2+));hexakis(platinum(2+))?
The canonical SMILES for 2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-9-[5-(trideuteriomethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-(4,5-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(4,6-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-methylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-5-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-6-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;hexakis(palladium(2+));hexakis(platinum(2+)) is Cc1cc(C)nc(-n2c3[c-]c(Oc4[c-]c(-c5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(-c5ccccn5)ccc4)[c-]c32)n1.Cc1cnc(-n2c3[c-]c(Oc4[c-]c(-c5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(-c5ccccn5)ccc4)[c-]c32)nc1.Cc1cnc(-n2c3[c-]c(Oc4[c-]c(-c5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(-c5ccccn5)ccc4)[c-]c32)nc1C.[2H]C([2H])([2H])c1cc(C)nc(-n2c3[c-]c(Oc4[c-]c(-c5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(-c5ccccn5)ccc4)[c-]c32)n1.[2H]C([2H])([2H])c1cnc(-n2c3[c-]c(Oc4[c-]c(-c5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(-c5ccccn5)ccc4)[c-]c32)nc1.[2H]C([2H])([2H])c1cnc(-n2c3[c-]c(Oc4[c-]c(-c5ccccn5)ccc4)ccc3c3ccc(Oc4[c-]c(-c5ccccn5)ccc4)[c-]c32)nc1C.[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].
What is the InChIKey of 2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-9-[5-(trideuteriomethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-(4,5-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(4,6-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-methylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-5-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-6-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;hexakis(palladium(2+));hexakis(platinum(2+))?
The InChIKey is UCIZALBZIHQXPW-HLSJMNPOSA-N. The full InChI is InChI=1S/4C40H25N5O2.2C39H23N5O2.6Pd.6Pt/c2*1-26-25-43-40(44-27(26)2)45-38-23-32(46-30-11-7-9-28(21-30)36-13-3-5-19-41-36)15-17-34(38)35-18-16-33(24-39(35)45)47-31-12-8-10-29(22-31)37-14-4-6-20-42-37;2*1-26-21-27(2)44-40(43-26)45-38-24-32(46-30-11-7-9-28(22-30)36-13-3-5-19-41-36)15-17-34(38)35-18-16-33(25-39(35)45)47-31-12-8-10-29(23-31)37-14-4-6-20-42-37;2*1-26-24-42-39(43-25-26)44-37-22-31(45-29-10-6-8-27(20-29)35-12-2-4-18-40-35)14-16-33(37)34-17-15-32(23-38(34)44)46-30-11-7-9-28(21-30)36-13-3-5-19-41-36;;;;;;;;;;;;/h2*3-20,25H,1-2H3;2*3-21H,1-2H3;2*2-19,24-25H,1H3;;;;;;;;;;;;/q6*-4;12*+2/i1D3;;1D3;;1D3;;;;;;;;;;;;;.
What are the key properties of 2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-9-[5-(trideuteriomethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-(4,5-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(4,6-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-methylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-5-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-6-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;hexakis(palladium(2+));hexakis(platinum(2+))?
2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-9-[5-(trideuteriomethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-(4,5-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(4,6-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-methylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-5-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-6-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;hexakis(palladium(2+));hexakis(platinum(2+)) has a molecular weight of 5436.03 g/mol, XLogP of 53.95, 45 rotatable bonds, 0 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-9-[5-(trideuteriomethyl)pyrimidin-2-yl]-1,8-dihydrocarbazole-1,8-diide;9-(4,5-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(4,6-dimethylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-(5-methylpyrimidin-2-yl)-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-5-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;9-[4-methyl-6-(trideuteriomethyl)pyrimidin-2-yl]-2,7-bis[(3-pyridin-2-ylbenzene-2-id-1-yl)oxy]-1,8-dihydrocarbazole-1,8-diide;hexakis(palladium(2+));hexakis(platinum(2+)) is sourced from PubChem (CID 158630605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).