2-[3-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole

C159H126N10O5Pt5S5 — CID 157373228

IUPAC2-[3-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole
SMILESCC(C)(C)C(c1[c-]c(Oc2[c-]c(-c3nccs3)ccc2)ccc1)(c1ccccn1)C(C)(C)C.CC(C)(C)c1ccc2c(c1)-c1cc(C(C)(C)C)ccc1C2(c1[c-]c(Oc2[c-]c(-c3nccs3)ccc2)ccc1)c1ccccn1.CC(C)(c1[c-]c(Oc2[c-]c(-c3nccs3)ccc2)ccc1)c1ccccn1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(Oc2[c-]c(C(c3ccccc3)(c3ccccc3)c3ccccn3)ccc2)cccc1-c1nccs1.[c-]1c(Oc2[c-]c(C3(c4ccccn4)c4ccccc4-c4ccccc43)ccc2)cccc1-c1nccs1
InChIInChI=1S/C41H36N2OS.C33H20N2OS.C33H22N2OS.C29H30N2OS.C23H18N2OS.5Pt/c1-39(2,3)28-16-18-35-33(25-28)34-26-29(40(4,5)6)17-19-36(34)41(35,37-15-7-8-20-42-37)30-12-10-14-32(24-30)44-31-13-9-11-27(23-31)38-43-21-22-45-38;1-3-15-29-27(13-1)28-14-2-4-16-30(28)33(29,31-17-5-6-18-34-31)24-10-8-12-26(22-24)36-25-11-7-9-23(21-25)32-35-19-20-37-32;1-3-12-26(13-4-1)33(27-14-5-2-6-15-27,31-19-7-8-20-34-31)28-16-10-18-30(24-28)36-29-17-9-11-25(23-29)32-35-21-22-37-32;1-27(2,3)29(28(4,5)6,25-15-7-8-16-30-25)22-12-10-14-24(20-22)32-23-13-9-11-21(19-23)26-31-17-18-33-26;1-23(2,21-11-3-4-12-24-21)18-8-6-10-20(16-18)26-19-9-5-7-17(15-19)22-25-13-14-27-22;;;;;/h7-22,25-26H,1-6H3;1-20H;1-22H;7-18H,1-6H3;3-14H,1-2H3;;;;;/q5*-2;5*+2
InChIKeyHZTFYTZVFPAYFS-UHFFFAOYSA-N
MW3392.55 g/mol
LogP40.38
Rot. Bonds27

About 2-[3-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole

2-[3-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole (PubChem CID 157373228) has the molecular formula C159H126N10O5Pt5S5 and a molecular weight of 3392.55 g/mol. Its IUPAC name is 2-[3-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole.

Molecular Properties

Compound Name2-[3-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole
PubChem CID157373228
Molecular FormulaC159H126N10O5Pt5S5
Molecular Weight3392.55 g/mol
Exact Mass3389.68
IUPAC Name2-[3-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole
SMILESCC(C)(C)C(c1[c-]c(Oc2[c-]c(-c3nccs3)ccc2)ccc1)(c1ccccn1)C(C)(C)C.CC(C)(C)c1ccc2c(c1)-c1cc(C(C)(C)C)ccc1C2(c1[c-]c(Oc2[c-]c(-c3nccs3)ccc2)ccc1)c1ccccn1.CC(C)(c1[c-]c(Oc2[c-]c(-c3nccs3)ccc2)ccc1)c1ccccn1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(Oc2[c-]c(C(c3ccccc3)(c3ccccc3)c3ccccn3)ccc2)cccc1-c1nccs1.[c-]1c(Oc2[c-]c(C3(c4ccccn4)c4ccccc4-c4ccccc43)ccc2)cccc1-c1nccs1
InChIInChI=1S/C41H36N2OS.C33H20N2OS.C33H22N2OS.C29H30N2OS.C23H18N2OS.5Pt/c1-39(2,3)28-16-18-35-33(25-28)34-26-29(40(4,5)6)17-19-36(34)41(35,37-15-7-8-20-42-37)30-12-10-14-32(24-30)44-31-13-9-11-27(23-31)38-43-21-22-45-38;1-3-15-29-27(13-1)28-14-2-4-16-30(28)33(29,31-17-5-6-18-34-31)24-10-8-12-26(22-24)36-25-11-7-9-23(21-25)32-35-19-20-37-32;1-3-12-26(13-4-1)33(27-14-5-2-6-15-27,31-19-7-8-20-34-31)28-16-10-18-30(24-28)36-29-17-9-11-25(23-29)32-35-21-22-37-32;1-27(2,3)29(28(4,5)6,25-15-7-8-16-30-25)22-12-10-14-24(20-22)32-23-13-9-11-21(19-23)26-31-17-18-33-26;1-23(2,21-11-3-4-12-24-21)18-8-6-10-20(16-18)26-19-9-5-7-17(15-19)22-25-13-14-27-22;;;;;/h7-22,25-26H,1-6H3;1-20H;1-22H;7-18H,1-6H3;3-14H,1-2H3;;;;;/q5*-2;5*+2
InChIKeyHZTFYTZVFPAYFS-UHFFFAOYSA-N
XLogP40.38
TPSA175.05 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds27
Heavy Atoms184
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003392.55
LogP ≤ 540.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

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

Analyze 2-[3-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-[3-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole?
The IUPAC name of 2-[3-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole (CID 157373228) is 2-[3-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole.
What is the SMILES notation for 2-[3-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole?
The canonical SMILES for 2-[3-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole is CC(C)(C)C(c1[c-]c(Oc2[c-]c(-c3nccs3)ccc2)ccc1)(c1ccccn1)C(C)(C)C.CC(C)(C)c1ccc2c(c1)-c1cc(C(C)(C)C)ccc1C2(c1[c-]c(Oc2[c-]c(-c3nccs3)ccc2)ccc1)c1ccccn1.CC(C)(c1[c-]c(Oc2[c-]c(-c3nccs3)ccc2)ccc1)c1ccccn1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(Oc2[c-]c(C(c3ccccc3)(c3ccccc3)c3ccccn3)ccc2)cccc1-c1nccs1.[c-]1c(Oc2[c-]c(C3(c4ccccn4)c4ccccc4-c4ccccc43)ccc2)cccc1-c1nccs1.
What is the InChIKey of 2-[3-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole?
The InChIKey is HZTFYTZVFPAYFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H36N2OS.C33H20N2OS.C33H22N2OS.C29H30N2OS.C23H18N2OS.5Pt/c1-39(2,3)28-16-18-35-33(25-28)34-26-29(40(4,5)6)17-19-36(34)41(35,37-15-7-8-20-42-37)30-12-10-14-32(24-30)44-31-13-9-11-27(23-31)38-43-21-22-45-38;1-3-15-29-27(13-1)28-14-2-4-16-30(28)33(29,31-17-5-6-18-34-31)24-10-8-12-26(22-24)36-25-11-7-9-23(21-25)32-35-19-20-37-32;1-3-12-26(13-4-1)33(27-14-5-2-6-15-27,31-19-7-8-20-34-31)28-16-10-18-30(24-28)36-29-17-9-11-25(23-29)32-35-21-22-37-32;1-27(2,3)29(28(4,5)6,25-15-7-8-16-30-25)22-12-10-14-24(20-22)32-23-13-9-11-21(19-23)26-31-17-18-33-26;1-23(2,21-11-3-4-12-24-21)18-8-6-10-20(16-18)26-19-9-5-7-17(15-19)22-25-13-14-27-22;;;;;/h7-22,25-26H,1-6H3;1-20H;1-22H;7-18H,1-6H3;3-14H,1-2H3;;;;;/q5*-2;5*+2.
What are the key properties of 2-[3-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole?
2-[3-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole has a molecular weight of 3392.55 g/mol, XLogP of 40.38, 27 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[3-(3,6-ditert-butyl-9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[diphenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2-pyridin-2-ylpropan-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(2,2,4,4-tetramethyl-3-pyridin-2-ylpentan-3-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole is sourced from PubChem (CID 157373228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).