2-bromo-9-(4-tert-butyl-2-pyridinyl)carbazole;9-(4-tert-butyl-2-pyridinyl)-2-(2-imidazol-1-yldibenzofuran-4-yl)oxycarbazole;9-(4-tert-butyl-2-pyridinyl)-2-[[2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)-3H-dibenzofuran-3-id-4-yl]oxy]-1H-carbazol-1-ide;deuteriomethanone;dichloroplatinum;1H-imidazole;2-imidazol-1-yldibenzofuran-4-ol;2-iodo-4-methoxydibenzofuran;methane;1-(4-methoxydibenzofuran-2-yl)imidazole;platinum;hexafluorophosphate;hydrobromide

C145H124Br2Cl2F6IN16O11PPt2-4 — CID 157223161

IUPAC2-bromo-9-(4-tert-butyl-2-pyridinyl)carbazole;9-(4-tert-butyl-2-pyridinyl)-2-(2-imidazol-1-yldibenzofuran-4-yl)oxycarbazole;9-(4-tert-butyl-2-pyridinyl)-2-[[2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)-3H-dibenzofuran-3-id-4-yl]oxy]-1H-carbazol-1-ide;deuteriomethanone;dichloroplatinum;1H-imidazole;2-imidazol-1-yldibenzofuran-4-ol;2-iodo-4-methoxydibenzofuran;methane;1-(4-methoxydibenzofuran-2-yl)imidazole;platinum;hexafluorophosphate;hydrobromide
SMILESBr.C.C.C.CC(C)(C)c1ccnc(-n2c3ccccc3c3ccc(Br)cc32)c1.CC(C)(C)c1ccnc(-n2c3ccccc3c3ccc(Oc4cc(-n5ccnc5)cc5c4oc4ccccc45)cc32)c1.COc1cc(-n2ccnc2)cc2c1oc1ccccc12.COc1cc(I)cc2c1oc1ccccc12.C[n+]1[c-]n(-c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(C(C)(C)C)ccn3)c3oc4ccccc4c3c2)cc1.Cl[Pt]Cl.F[P-](F)(F)(F)(F)F.Oc1cc(-n2ccnc2)cc2c1oc1ccccc12.[2H][C-]=O.[Pt].c1c[nH]cn1
InChIInChI=1S/C37H28N4O2.C36H28N4O2.C21H19BrN2.C16H12N2O2.C15H10N2O2.C13H9IO2.C3H4N2.CHO.3CH4.BrH.2ClH.F6P.2Pt/c1-37(2,3)24-15-16-38-35(19-24)41-31-11-7-5-9-27(31)28-14-13-26(22-32(28)41)42-34-21-25(40-18-17-39(4)23-40)20-30-29-10-6-8-12-33(29)43-36(30)34;1-36(2,3)23-14-15-38-34(18-23)40-30-10-6-4-8-26(30)27-13-12-25(21-31(27)40)41-33-20-24(39-17-16-37-22-39)19-29-28-9-5-7-11-32(28)42-35(29)33;1-21(2,3)14-10-11-23-20(12-14)24-18-7-5-4-6-16(18)17-9-8-15(22)13-19(17)24;1-19-15-9-11(18-7-6-17-10-18)8-13-12-4-2-3-5-14(12)20-16(13)15;18-13-8-10(17-6-5-16-9-17)7-12-11-3-1-2-4-14(11)19-15(12)13;1-15-12-7-8(14)6-10-9-4-2-3-5-11(9)16-13(10)12;1-2-5-3-4-1;1-2;;;;;;;1-7(2,3,4,5)6;;/h5-20H,1-4H3;4-22H,1-3H3;4-13H,1-3H3;2-10H,1H3;1-9,18H;2-7H,1H3;1-3H,(H,4,5);1H;3*1H4;3*1H;;;/q-2;;;;;;;-1;;;;;;;-1;;+2/p-2/i;;;;;;;1D;;;;;;;;;
InChIKeyYNPHSEFBSGITSK-PRAAFDBESA-L
MW3160.43 g/mol
LogP42.61
Rot. Bonds13

About 2-bromo-9-(4-tert-butyl-2-pyridinyl)carbazole;9-(4-tert-butyl-2-pyridinyl)-2-(2-imidazol-1-yldibenzofuran-4-yl)oxycarbazole;9-(4-tert-butyl-2-pyridinyl)-2-[[2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)-3H-dibenzofuran-3-id-4-yl]oxy]-1H-carbazol-1-ide;deuteriomethanone;dichloroplatinum;1H-imidazole;2-imidazol-1-yldibenzofuran-4-ol;2-iodo-4-methoxydibenzofuran;methane;1-(4-methoxydibenzofuran-2-yl)imidazole;platinum;hexafluorophosphate;hydrobromide

2-bromo-9-(4-tert-butyl-2-pyridinyl)carbazole;9-(4-tert-butyl-2-pyridinyl)-2-(2-imidazol-1-yldibenzofuran-4-yl)oxycarbazole;9-(4-tert-butyl-2-pyridinyl)-2-[[2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)-3H-dibenzofuran-3-id-4-yl]oxy]-1H-carbazol-1-ide;deuteriomethanone;dichloroplatinum;1H-imidazole;2-imidazol-1-yldibenzofuran-4-ol;2-iodo-4-methoxydibenzofuran;methane;1-(4-methoxydibenzofuran-2-yl)imidazole;platinum;hexafluorophosphate;hydrobromide (PubChem CID 157223161) has the molecular formula C145H124Br2Cl2F6IN16O11PPt2-4 and a molecular weight of 3160.43 g/mol. Its IUPAC name is 2-bromo-9-(4-tert-butyl-2-pyridinyl)carbazole;9-(4-tert-butyl-2-pyridinyl)-2-(2-imidazol-1-yldibenzofuran-4-yl)oxycarbazole;9-(4-tert-butyl-2-pyridinyl)-2-[[2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)-3H-dibenzofuran-3-id-4-yl]oxy]-1H-carbazol-1-ide;deuteriomethanone;dichloroplatinum;1H-imidazole;2-imidazol-1-yldibenzofuran-4-ol;2-iodo-4-methoxydibenzofuran;methane;1-(4-methoxydibenzofuran-2-yl)imidazole;platinum;hexafluorophosphate;hydrobromide.

Molecular Properties

Compound Name2-bromo-9-(4-tert-butyl-2-pyridinyl)carbazole;9-(4-tert-butyl-2-pyridinyl)-2-(2-imidazol-1-yldibenzofuran-4-yl)oxycarbazole;9-(4-tert-butyl-2-pyridinyl)-2-[[2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)-3H-dibenzofuran-3-id-4-yl]oxy]-1H-carbazol-1-ide;deuteriomethanone;dichloroplatinum;1H-imidazole;2-imidazol-1-yldibenzofuran-4-ol;2-iodo-4-methoxydibenzofuran;methane;1-(4-methoxydibenzofuran-2-yl)imidazole;platinum;hexafluorophosphate;hydrobromide
PubChem CID157223161
Molecular FormulaC145H124Br2Cl2F6IN16O11PPt2-4
Molecular Weight3160.43 g/mol
Exact Mass3155.54
IUPAC Name2-bromo-9-(4-tert-butyl-2-pyridinyl)carbazole;9-(4-tert-butyl-2-pyridinyl)-2-(2-imidazol-1-yldibenzofuran-4-yl)oxycarbazole;9-(4-tert-butyl-2-pyridinyl)-2-[[2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)-3H-dibenzofuran-3-id-4-yl]oxy]-1H-carbazol-1-ide;deuteriomethanone;dichloroplatinum;1H-imidazole;2-imidazol-1-yldibenzofuran-4-ol;2-iodo-4-methoxydibenzofuran;methane;1-(4-methoxydibenzofuran-2-yl)imidazole;platinum;hexafluorophosphate;hydrobromide
SMILESBr.C.C.C.CC(C)(C)c1ccnc(-n2c3ccccc3c3ccc(Br)cc32)c1.CC(C)(C)c1ccnc(-n2c3ccccc3c3ccc(Oc4cc(-n5ccnc5)cc5c4oc4ccccc45)cc32)c1.COc1cc(-n2ccnc2)cc2c1oc1ccccc12.COc1cc(I)cc2c1oc1ccccc12.C[n+]1[c-]n(-c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(C(C)(C)C)ccn3)c3oc4ccccc4c3c2)cc1.Cl[Pt]Cl.F[P-](F)(F)(F)(F)F.Oc1cc(-n2ccnc2)cc2c1oc1ccccc12.[2H][C-]=O.[Pt].c1c[nH]cn1
InChIInChI=1S/C37H28N4O2.C36H28N4O2.C21H19BrN2.C16H12N2O2.C15H10N2O2.C13H9IO2.C3H4N2.CHO.3CH4.BrH.2ClH.F6P.2Pt/c1-37(2,3)24-15-16-38-35(19-24)41-31-11-7-5-9-27(31)28-14-13-26(22-32(28)41)42-34-21-25(40-18-17-39(4)23-40)20-30-29-10-6-8-12-33(29)43-36(30)34;1-36(2,3)23-14-15-38-34(18-23)40-30-10-6-4-8-26(30)27-13-12-25(21-31(27)40)41-33-20-24(39-17-16-37-22-39)19-29-28-9-5-7-11-32(28)42-35(29)33;1-21(2,3)14-10-11-23-20(12-14)24-18-7-5-4-6-16(18)17-9-8-15(22)13-19(17)24;1-19-15-9-11(18-7-6-17-10-18)8-13-12-4-2-3-5-14(12)20-16(13)15;18-13-8-10(17-6-5-16-9-17)7-12-11-3-1-2-4-14(11)19-15(12)13;1-15-12-7-8(14)6-10-9-4-2-3-5-11(9)16-13(10)12;1-2-5-3-4-1;1-2;;;;;;;1-7(2,3,4,5)6;;/h5-20H,1-4H3;4-22H,1-3H3;4-13H,1-3H3;2-10H,1H3;1-9,18H;2-7H,1H3;1-3H,(H,4,5);1H;3*1H4;3*1H;;;/q-2;;;;;;;-1;;;;;;;-1;;+2/p-2/i;;;;;;;1D;;;;;;;;;
InChIKeyYNPHSEFBSGITSK-PRAAFDBESA-L
XLogP42.61
TPSA284.33 Ų
H-Bond Donors2
H-Bond Acceptors25
Rotatable Bonds13
Heavy Atoms186
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003160.43
LogP ≤ 542.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze 2-bromo-9-(4-tert-butyl-2-pyridinyl)carbazole;9-(4-tert-butyl-2-pyridinyl)-2-(2-imidazol-1-yldibenzofuran-4-yl)oxycarbazole;9-(4-tert-butyl-2-pyridinyl)-2-[[2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)-3H-dibenzofuran-3-id-4-yl]oxy]-1H-carbazol-1-ide;deuteriomethanone;dichloroplatinum;1H-imidazole;2-imidazol-1-yldibenzofuran-4-ol;2-iodo-4-methoxydibenzofuran;methane;1-(4-methoxydibenzofuran-2-yl)imidazole;platinum;hexafluorophosphate;hydrobromide with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-bromo-9-(4-tert-butyl-2-pyridinyl)carbazole;9-(4-tert-butyl-2-pyridinyl)-2-(2-imidazol-1-yldibenzofuran-4-yl)oxycarbazole;9-(4-tert-butyl-2-pyridinyl)-2-[[2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)-3H-dibenzofuran-3-id-4-yl]oxy]-1H-carbazol-1-ide;deuteriomethanone;dichloroplatinum;1H-imidazole;2-imidazol-1-yldibenzofuran-4-ol;2-iodo-4-methoxydibenzofuran;methane;1-(4-methoxydibenzofuran-2-yl)imidazole;platinum;hexafluorophosphate;hydrobromide?
The IUPAC name of 2-bromo-9-(4-tert-butyl-2-pyridinyl)carbazole;9-(4-tert-butyl-2-pyridinyl)-2-(2-imidazol-1-yldibenzofuran-4-yl)oxycarbazole;9-(4-tert-butyl-2-pyridinyl)-2-[[2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)-3H-dibenzofuran-3-id-4-yl]oxy]-1H-carbazol-1-ide;deuteriomethanone;dichloroplatinum;1H-imidazole;2-imidazol-1-yldibenzofuran-4-ol;2-iodo-4-methoxydibenzofuran;methane;1-(4-methoxydibenzofuran-2-yl)imidazole;platinum;hexafluorophosphate;hydrobromide (CID 157223161) is 2-bromo-9-(4-tert-butyl-2-pyridinyl)carbazole;9-(4-tert-butyl-2-pyridinyl)-2-(2-imidazol-1-yldibenzofuran-4-yl)oxycarbazole;9-(4-tert-butyl-2-pyridinyl)-2-[[2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)-3H-dibenzofuran-3-id-4-yl]oxy]-1H-carbazol-1-ide;deuteriomethanone;dichloroplatinum;1H-imidazole;2-imidazol-1-yldibenzofuran-4-ol;2-iodo-4-methoxydibenzofuran;methane;1-(4-methoxydibenzofuran-2-yl)imidazole;platinum;hexafluorophosphate;hydrobromide.
What is the SMILES notation for 2-bromo-9-(4-tert-butyl-2-pyridinyl)carbazole;9-(4-tert-butyl-2-pyridinyl)-2-(2-imidazol-1-yldibenzofuran-4-yl)oxycarbazole;9-(4-tert-butyl-2-pyridinyl)-2-[[2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)-3H-dibenzofuran-3-id-4-yl]oxy]-1H-carbazol-1-ide;deuteriomethanone;dichloroplatinum;1H-imidazole;2-imidazol-1-yldibenzofuran-4-ol;2-iodo-4-methoxydibenzofuran;methane;1-(4-methoxydibenzofuran-2-yl)imidazole;platinum;hexafluorophosphate;hydrobromide?
The canonical SMILES for 2-bromo-9-(4-tert-butyl-2-pyridinyl)carbazole;9-(4-tert-butyl-2-pyridinyl)-2-(2-imidazol-1-yldibenzofuran-4-yl)oxycarbazole;9-(4-tert-butyl-2-pyridinyl)-2-[[2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)-3H-dibenzofuran-3-id-4-yl]oxy]-1H-carbazol-1-ide;deuteriomethanone;dichloroplatinum;1H-imidazole;2-imidazol-1-yldibenzofuran-4-ol;2-iodo-4-methoxydibenzofuran;methane;1-(4-methoxydibenzofuran-2-yl)imidazole;platinum;hexafluorophosphate;hydrobromide is Br.C.C.C.CC(C)(C)c1ccnc(-n2c3ccccc3c3ccc(Br)cc32)c1.CC(C)(C)c1ccnc(-n2c3ccccc3c3ccc(Oc4cc(-n5ccnc5)cc5c4oc4ccccc45)cc32)c1.COc1cc(-n2ccnc2)cc2c1oc1ccccc12.COc1cc(I)cc2c1oc1ccccc12.C[n+]1[c-]n(-c2[c-]c(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(C(C)(C)C)ccn3)c3oc4ccccc4c3c2)cc1.Cl[Pt]Cl.F[P-](F)(F)(F)(F)F.Oc1cc(-n2ccnc2)cc2c1oc1ccccc12.[2H][C-]=O.[Pt].c1c[nH]cn1.
What is the InChIKey of 2-bromo-9-(4-tert-butyl-2-pyridinyl)carbazole;9-(4-tert-butyl-2-pyridinyl)-2-(2-imidazol-1-yldibenzofuran-4-yl)oxycarbazole;9-(4-tert-butyl-2-pyridinyl)-2-[[2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)-3H-dibenzofuran-3-id-4-yl]oxy]-1H-carbazol-1-ide;deuteriomethanone;dichloroplatinum;1H-imidazole;2-imidazol-1-yldibenzofuran-4-ol;2-iodo-4-methoxydibenzofuran;methane;1-(4-methoxydibenzofuran-2-yl)imidazole;platinum;hexafluorophosphate;hydrobromide?
The InChIKey is YNPHSEFBSGITSK-PRAAFDBESA-L. The full InChI is InChI=1S/C37H28N4O2.C36H28N4O2.C21H19BrN2.C16H12N2O2.C15H10N2O2.C13H9IO2.C3H4N2.CHO.3CH4.BrH.2ClH.F6P.2Pt/c1-37(2,3)24-15-16-38-35(19-24)41-31-11-7-5-9-27(31)28-14-13-26(22-32(28)41)42-34-21-25(40-18-17-39(4)23-40)20-30-29-10-6-8-12-33(29)43-36(30)34;1-36(2,3)23-14-15-38-34(18-23)40-30-10-6-4-8-26(30)27-13-12-25(21-31(27)40)41-33-20-24(39-17-16-37-22-39)19-29-28-9-5-7-11-32(28)42-35(29)33;1-21(2,3)14-10-11-23-20(12-14)24-18-7-5-4-6-16(18)17-9-8-15(22)13-19(17)24;1-19-15-9-11(18-7-6-17-10-18)8-13-12-4-2-3-5-14(12)20-16(13)15;18-13-8-10(17-6-5-16-9-17)7-12-11-3-1-2-4-14(11)19-15(12)13;1-15-12-7-8(14)6-10-9-4-2-3-5-11(9)16-13(10)12;1-2-5-3-4-1;1-2;;;;;;;1-7(2,3,4,5)6;;/h5-20H,1-4H3;4-22H,1-3H3;4-13H,1-3H3;2-10H,1H3;1-9,18H;2-7H,1H3;1-3H,(H,4,5);1H;3*1H4;3*1H;;;/q-2;;;;;;;-1;;;;;;;-1;;+2/p-2/i;;;;;;;1D;;;;;;;;;.
What are the key properties of 2-bromo-9-(4-tert-butyl-2-pyridinyl)carbazole;9-(4-tert-butyl-2-pyridinyl)-2-(2-imidazol-1-yldibenzofuran-4-yl)oxycarbazole;9-(4-tert-butyl-2-pyridinyl)-2-[[2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)-3H-dibenzofuran-3-id-4-yl]oxy]-1H-carbazol-1-ide;deuteriomethanone;dichloroplatinum;1H-imidazole;2-imidazol-1-yldibenzofuran-4-ol;2-iodo-4-methoxydibenzofuran;methane;1-(4-methoxydibenzofuran-2-yl)imidazole;platinum;hexafluorophosphate;hydrobromide?
2-bromo-9-(4-tert-butyl-2-pyridinyl)carbazole;9-(4-tert-butyl-2-pyridinyl)-2-(2-imidazol-1-yldibenzofuran-4-yl)oxycarbazole;9-(4-tert-butyl-2-pyridinyl)-2-[[2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)-3H-dibenzofuran-3-id-4-yl]oxy]-1H-carbazol-1-ide;deuteriomethanone;dichloroplatinum;1H-imidazole;2-imidazol-1-yldibenzofuran-4-ol;2-iodo-4-methoxydibenzofuran;methane;1-(4-methoxydibenzofuran-2-yl)imidazole;platinum;hexafluorophosphate;hydrobromide has a molecular weight of 3160.43 g/mol, XLogP of 42.61, 13 rotatable bonds, 2 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-9-(4-tert-butyl-2-pyridinyl)carbazole;9-(4-tert-butyl-2-pyridinyl)-2-(2-imidazol-1-yldibenzofuran-4-yl)oxycarbazole;9-(4-tert-butyl-2-pyridinyl)-2-[[2-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)-3H-dibenzofuran-3-id-4-yl]oxy]-1H-carbazol-1-ide;deuteriomethanone;dichloroplatinum;1H-imidazole;2-imidazol-1-yldibenzofuran-4-ol;2-iodo-4-methoxydibenzofuran;methane;1-(4-methoxydibenzofuran-2-yl)imidazole;platinum;hexafluorophosphate;hydrobromide is sourced from PubChem (CID 157223161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).