2-[3-[2-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-[diphenyl(pyridin-2-yl)methyl]-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;9-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-2-(1-pyridin-2-ylcyclohexyl)-1H-carbazol-1-ide;pentakis(palladium(2+));2-[3-[2-(9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-(2-pyridin-2-ylpropan-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole

C187H136N16O4Pd5 — CID 157347680

About 2-[3-[2-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-[diphenyl(pyridin-2-yl)methyl]-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;9-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-2-(1-pyridin-2-ylcyclohexyl)-1H-carbazol-1-ide;pentakis(palladium(2+));2-[3-[2-(9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-(2-pyridin-2-ylpropan-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole

2-[3-[2-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-[diphenyl(pyridin-2-yl)methyl]-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;9-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-2-(1-pyridin-2-ylcyclohexyl)-1H-carbazol-1-ide;pentakis(palladium(2+));2-[3-[2-(9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-(2-pyridin-2-ylpropan-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole (PubChem CID 157347680) has the molecular formula C187H136N16O4Pd5 and a molecular weight of 3203.35 g/mol. Its IUPAC name is 2-[3-[2-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-[diphenyl(pyridin-2-yl)methyl]-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;9-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-2-(1-pyridin-2-ylcyclohexyl)-1H-carbazol-1-ide;pentakis(palladium(2+));2-[3-[2-(9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-(2-pyridin-2-ylpropan-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole.

Molecular Properties

• Compound Name: 2-[3-[2-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-[diphenyl(pyridin-2-yl)methyl]-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;9-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-2-(1-pyridin-2-ylcyclohexyl)-1H-carbazol-1-ide;pentakis(palladium(2+));2-[3-[2-(9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-(2-pyridin-2-ylpropan-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole
• PubChem CID: 157347680
• Molecular Formula: C187H136N16O4Pd5
• Molecular Weight: 3203.35 g/mol
• Exact Mass: 3198.61
• IUPAC Name: 2-[3-[2-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-[diphenyl(pyridin-2-yl)methyl]-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;9-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-2-(1-pyridin-2-ylcyclohexyl)-1H-carbazol-1-ide;pentakis(palladium(2+));2-[3-[2-(9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-(2-pyridin-2-ylpropan-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole
• SMILES: CC(C)(C)c1ccc2c(c1)-c1cc(C(C)(C)C)ccc1C2(c1[c-]c2c(cc1)c1ccccc1n2-c1[c-]c(-c2ncco2)ccc1)c1ccccn1.CC(C)(c1[c-]c2c(cc1)c1ccccc1n2-c1[c-]c(-c2ncco2)ccc1)c1ccccn1.Cn1ccnc1-c1[c-]c(-n2c3[c-]c(C4(c5ccccn5)CCCCC4)ccc3c3ccccc32)ccc1.[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[c-]1c(-c2ncco2)cccc1-n1c2[c-]c(C(c3ccccc3)(c3ccccc3)c3ccccn3)ccc2c2ccccc21.[c-]1c(-c2ncco2)cccc1-n1c2[c-]c(C3(c4ccccn4)c4ccccc4-c4ccccc43)ccc2c2ccccc21
• InChI: InChI=1S/C47H39N3O.C39H23N3O.C39H25N3O.C33H28N4.C29H21N3O.5Pd/c1-45(2,3)31-18-21-39-37(27-31)38-28-32(46(4,5)6)19-22-40(38)47(39,43-16-9-10-23-48-43)33-17-20-36-35-14-7-8-15-41(35)50(42(36)29-33)34-13-11-12-30(26-34)44-49-24-25-51-44;1-4-15-33-29(12-1)30-13-2-5-16-34(30)39(33,37-18-7-8-21-40-37)27-19-20-32-31-14-3-6-17-35(31)42(36(32)25-27)28-11-9-10-26(24-28)38-41-22-23-43-38;1-3-13-29(14-4-1)39(30-15-5-2-6-16-30,37-20-9-10-23-40-37)31-21-22-34-33-18-7-8-19-35(33)42(36(34)27-31)32-17-11-12-28(26-32)38-41-24-25-43-38;1-36-21-20-35-32(36)24-10-9-11-26(22-24)37-29-13-4-3-12-27(29)28-16-15-25(23-30(28)37)33(17-6-2-7-18-33)31-14-5-8-19-34-31;1-29(2,27-12-5-6-15-30-27)21-13-14-24-23-10-3-4-11-25(23)32(26(24)19-21)22-9-7-8-20(18-22)28-31-16-17-33-28;;;;;/h7-25,27-28H,1-6H3;1-23H;1-25H;3-5,8-16,19-21H,2,6-7,17-18H2,1H3;3-17H,1-2H3;;;;;/q5*-2;5*+2
• InChIKey: XXJFXSCDLOYTBX-UHFFFAOYSA-N
• XLogP: 43.18
• TPSA: 211.04 Ų
• H-Bond Acceptors: 20
• Rotatable Bonds: 22
• Heavy Atoms: 212
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3203.35
LogP ≤ 5	43.18
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': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[3-[2-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-[diphenyl(pyridin-2-yl)methyl]-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;9-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-2-(1-pyridin-2-ylcyclohexyl)-1H-carbazol-1-ide;pentakis(palladium(2+));2-[3-[2-(9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-(2-pyridin-2-ylpropan-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole?

The IUPAC name of 2-[3-[2-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-[diphenyl(pyridin-2-yl)methyl]-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;9-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-2-(1-pyridin-2-ylcyclohexyl)-1H-carbazol-1-ide;pentakis(palladium(2+));2-[3-[2-(9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-(2-pyridin-2-ylpropan-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole (CID 157347680) is 2-[3-[2-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-[diphenyl(pyridin-2-yl)methyl]-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;9-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-2-(1-pyridin-2-ylcyclohexyl)-1H-carbazol-1-ide;pentakis(palladium(2+));2-[3-[2-(9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-(2-pyridin-2-ylpropan-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole.

What is the SMILES notation for 2-[3-[2-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-[diphenyl(pyridin-2-yl)methyl]-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;9-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-2-(1-pyridin-2-ylcyclohexyl)-1H-carbazol-1-ide;pentakis(palladium(2+));2-[3-[2-(9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-(2-pyridin-2-ylpropan-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole?

The canonical SMILES for 2-[3-[2-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-[diphenyl(pyridin-2-yl)methyl]-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;9-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-2-(1-pyridin-2-ylcyclohexyl)-1H-carbazol-1-ide;pentakis(palladium(2+));2-[3-[2-(9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-(2-pyridin-2-ylpropan-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole is CC(C)(C)c1ccc2c(c1)-c1cc(C(C)(C)C)ccc1C2(c1[c-]c2c(cc1)c1ccccc1n2-c1[c-]c(-c2ncco2)ccc1)c1ccccn1.CC(C)(c1[c-]c2c(cc1)c1ccccc1n2-c1[c-]c(-c2ncco2)ccc1)c1ccccn1.Cn1ccnc1-c1[c-]c(-n2c3[c-]c(C4(c5ccccn5)CCCCC4)ccc3c3ccccc32)ccc1.[Pd+2].[Pd+2].[Pd+2].[Pd+2].[Pd+2].[c-]1c(-c2ncco2)cccc1-n1c2[c-]c(C(c3ccccc3)(c3ccccc3)c3ccccn3)ccc2c2ccccc21.[c-]1c(-c2ncco2)cccc1-n1c2[c-]c(C3(c4ccccn4)c4ccccc4-c4ccccc43)ccc2c2ccccc21.

What is the InChIKey of 2-[3-[2-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-[diphenyl(pyridin-2-yl)methyl]-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;9-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-2-(1-pyridin-2-ylcyclohexyl)-1H-carbazol-1-ide;pentakis(palladium(2+));2-[3-[2-(9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-(2-pyridin-2-ylpropan-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole?

The InChIKey is XXJFXSCDLOYTBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C47H39N3O.C39H23N3O.C39H25N3O.C33H28N4.C29H21N3O.5Pd/c1-45(2,3)31-18-21-39-37(27-31)38-28-32(46(4,5)6)19-22-40(38)47(39,43-16-9-10-23-48-43)33-17-20-36-35-14-7-8-15-41(35)50(42(36)29-33)34-13-11-12-30(26-34)44-49-24-25-51-44;1-4-15-33-29(12-1)30-13-2-5-16-34(30)39(33,37-18-7-8-21-40-37)27-19-20-32-31-14-3-6-17-35(31)42(36(32)25-27)28-11-9-10-26(24-28)38-41-22-23-43-38;1-3-13-29(14-4-1)39(30-15-5-2-6-16-30,37-20-9-10-23-40-37)31-21-22-34-33-18-7-8-19-35(33)42(36(34)27-31)32-17-11-12-28(26-32)38-41-24-25-43-38;1-36-21-20-35-32(36)24-10-9-11-26(22-24)37-29-13-4-3-12-27(29)28-16-15-25(23-30(28)37)33(17-6-2-7-18-33)31-14-5-8-19-34-31;1-29(2,27-12-5-6-15-30-27)21-13-14-24-23-10-3-4-11-25(23)32(26(24)19-21)22-9-7-8-20(18-22)28-31-16-17-33-28;;;;;/h7-25,27-28H,1-6H3;1-23H;1-25H;3-5,8-16,19-21H,2,6-7,17-18H2,1H3;3-17H,1-2H3;;;;;/q5*-2;5*+2.

What are the key properties of 2-[3-[2-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-[diphenyl(pyridin-2-yl)methyl]-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;9-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-2-(1-pyridin-2-ylcyclohexyl)-1H-carbazol-1-ide;pentakis(palladium(2+));2-[3-[2-(9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-(2-pyridin-2-ylpropan-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole?

2-[3-[2-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-[diphenyl(pyridin-2-yl)methyl]-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;9-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-2-(1-pyridin-2-ylcyclohexyl)-1H-carbazol-1-ide;pentakis(palladium(2+));2-[3-[2-(9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-(2-pyridin-2-ylpropan-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole has a molecular weight of 3203.35 g/mol, XLogP of 43.18, 22 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-[2-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-[diphenyl(pyridin-2-yl)methyl]-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;9-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-2-(1-pyridin-2-ylcyclohexyl)-1H-carbazol-1-ide;pentakis(palladium(2+));2-[3-[2-(9-pyridin-2-ylfluoren-9-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole;2-[3-[2-(2-pyridin-2-ylpropan-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-1,3-oxazole is sourced from PubChem (CID 157347680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).