9-[3-(2,7-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-2,7-diphenylcarbazole;9-[3-(3,6-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-3,6-diphenylcarbazole;2-phenyl-9-[3-(2-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(2,4,6-trifluorophenyl)phenyl]carbazole;3-phenyl-9-[3-(3-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]carbazole

C220H128F24N8 — CID 158178481

IUPAC9-[3-(2,7-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-2,7-diphenylcarbazole;9-[3-(3,6-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-3,6-diphenylcarbazole;2-phenyl-9-[3-(2-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(2,4,6-trifluorophenyl)phenyl]carbazole;3-phenyl-9-[3-(3-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]carbazole
SMILESFc1cc(-c2cc(-n3c4cc(-c5ccccc5)ccc4c4ccc(-c5ccccc5)cc43)c(C(F)(F)F)c(-n3c4cc(-c5ccccc5)ccc4c4ccc(-c5ccccc5)cc43)c2)cc(F)c1F.Fc1cc(-c2cc(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc43)c(C(F)(F)F)c(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc43)c2)cc(F)c1F.Fc1cc(-c2cc(-n3c4ccccc4c4cc(-c5ccccc5)ccc43)c(C(F)(F)F)c(-n3c4ccccc4c4cc(-c5ccccc5)ccc43)c2)cc(F)c1F.Fc1cc(F)c(-c2cc(-n3c4ccccc4c4ccc(-c5ccccc5)cc43)c(C(F)(F)F)c(-n3c4ccccc4c4ccc(-c5ccccc5)cc43)c2)c(F)c1
InChIInChI=1S/2C61H36F6N2.2C49H28F6N2/c62-51-29-45(30-52(63)60(51)64)46-35-57(68-53-31-41(37-13-5-1-6-14-37)21-25-47(53)48-26-22-42(32-54(48)68)38-15-7-2-8-16-38)59(61(65,66)67)58(36-46)69-55-33-43(39-17-9-3-10-18-39)23-27-49(55)50-28-24-44(34-56(50)69)40-19-11-4-12-20-40;62-51-33-45(34-52(63)60(51)64)46-35-57(68-53-25-21-41(37-13-5-1-6-14-37)29-47(53)48-30-42(22-26-54(48)68)38-15-7-2-8-16-38)59(61(65,66)67)58(36-46)69-55-27-23-43(39-17-9-3-10-18-39)31-49(55)50-32-44(24-28-56(50)69)40-19-11-4-12-20-40;50-34-27-39(51)47(40(52)28-34)33-25-45(56-41-17-9-7-15-35(41)37-21-19-31(23-43(37)56)29-11-3-1-4-12-29)48(49(53,54)55)46(26-33)57-42-18-10-8-16-36(42)38-22-20-32(24-44(38)57)30-13-5-2-6-14-30;50-39-25-33(26-40(51)48(39)52)34-27-45(56-41-17-9-7-15-35(41)37-23-31(19-21-43(37)56)29-11-3-1-4-12-29)47(49(53,54)55)46(28-34)57-42-18-10-8-16-36(42)38-24-32(20-22-44(38)57)30-13-5-2-6-14-30/h2*1-36H;2*1-28H
InChIKeyFYHBGOXKDFYWBL-UHFFFAOYSA-N
MW3339.45 g/mol
LogP63.94
Rot. Bonds24

About 9-[3-(2,7-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-2,7-diphenylcarbazole;9-[3-(3,6-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-3,6-diphenylcarbazole;2-phenyl-9-[3-(2-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(2,4,6-trifluorophenyl)phenyl]carbazole;3-phenyl-9-[3-(3-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]carbazole

9-[3-(2,7-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-2,7-diphenylcarbazole;9-[3-(3,6-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-3,6-diphenylcarbazole;2-phenyl-9-[3-(2-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(2,4,6-trifluorophenyl)phenyl]carbazole;3-phenyl-9-[3-(3-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]carbazole (PubChem CID 158178481) has the molecular formula C220H128F24N8 and a molecular weight of 3339.45 g/mol. Its IUPAC name is 9-[3-(2,7-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-2,7-diphenylcarbazole;9-[3-(3,6-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-3,6-diphenylcarbazole;2-phenyl-9-[3-(2-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(2,4,6-trifluorophenyl)phenyl]carbazole;3-phenyl-9-[3-(3-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]carbazole.

Molecular Properties

Compound Name9-[3-(2,7-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-2,7-diphenylcarbazole;9-[3-(3,6-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-3,6-diphenylcarbazole;2-phenyl-9-[3-(2-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(2,4,6-trifluorophenyl)phenyl]carbazole;3-phenyl-9-[3-(3-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]carbazole
PubChem CID158178481
Molecular FormulaC220H128F24N8
Molecular Weight3339.45 g/mol
Exact Mass3336.99
IUPAC Name9-[3-(2,7-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-2,7-diphenylcarbazole;9-[3-(3,6-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-3,6-diphenylcarbazole;2-phenyl-9-[3-(2-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(2,4,6-trifluorophenyl)phenyl]carbazole;3-phenyl-9-[3-(3-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]carbazole
SMILESFc1cc(-c2cc(-n3c4cc(-c5ccccc5)ccc4c4ccc(-c5ccccc5)cc43)c(C(F)(F)F)c(-n3c4cc(-c5ccccc5)ccc4c4ccc(-c5ccccc5)cc43)c2)cc(F)c1F.Fc1cc(-c2cc(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc43)c(C(F)(F)F)c(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc43)c2)cc(F)c1F.Fc1cc(-c2cc(-n3c4ccccc4c4cc(-c5ccccc5)ccc43)c(C(F)(F)F)c(-n3c4ccccc4c4cc(-c5ccccc5)ccc43)c2)cc(F)c1F.Fc1cc(F)c(-c2cc(-n3c4ccccc4c4ccc(-c5ccccc5)cc43)c(C(F)(F)F)c(-n3c4ccccc4c4ccc(-c5ccccc5)cc43)c2)c(F)c1
InChIInChI=1S/2C61H36F6N2.2C49H28F6N2/c62-51-29-45(30-52(63)60(51)64)46-35-57(68-53-31-41(37-13-5-1-6-14-37)21-25-47(53)48-26-22-42(32-54(48)68)38-15-7-2-8-16-38)59(61(65,66)67)58(36-46)69-55-33-43(39-17-9-3-10-18-39)23-27-49(55)50-28-24-44(34-56(50)69)40-19-11-4-12-20-40;62-51-33-45(34-52(63)60(51)64)46-35-57(68-53-25-21-41(37-13-5-1-6-14-37)29-47(53)48-30-42(22-26-54(48)68)38-15-7-2-8-16-38)59(61(65,66)67)58(36-46)69-55-27-23-43(39-17-9-3-10-18-39)31-49(55)50-32-44(24-28-56(50)69)40-19-11-4-12-20-40;50-34-27-39(51)47(40(52)28-34)33-25-45(56-41-17-9-7-15-35(41)37-21-19-31(23-43(37)56)29-11-3-1-4-12-29)48(49(53,54)55)46(26-33)57-42-18-10-8-16-36(42)38-22-20-32(24-44(38)57)30-13-5-2-6-14-30;50-39-25-33(26-40(51)48(39)52)34-27-45(56-41-17-9-7-15-35(41)37-23-31(19-21-43(37)56)29-11-3-1-4-12-29)47(49(53,54)55)46(28-34)57-42-18-10-8-16-36(42)38-24-32(20-22-44(38)57)30-13-5-2-6-14-30/h2*1-36H;2*1-28H
InChIKeyFYHBGOXKDFYWBL-UHFFFAOYSA-N
XLogP63.94
TPSA39.44 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds24
Heavy Atoms252
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003339.45
LogP ≤ 563.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

Analyze 9-[3-(2,7-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-2,7-diphenylcarbazole;9-[3-(3,6-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-3,6-diphenylcarbazole;2-phenyl-9-[3-(2-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(2,4,6-trifluorophenyl)phenyl]carbazole;3-phenyl-9-[3-(3-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]carbazole with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 9-[3-(2,7-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-2,7-diphenylcarbazole;9-[3-(3,6-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-3,6-diphenylcarbazole;2-phenyl-9-[3-(2-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(2,4,6-trifluorophenyl)phenyl]carbazole;3-phenyl-9-[3-(3-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]carbazole?
The IUPAC name of 9-[3-(2,7-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-2,7-diphenylcarbazole;9-[3-(3,6-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-3,6-diphenylcarbazole;2-phenyl-9-[3-(2-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(2,4,6-trifluorophenyl)phenyl]carbazole;3-phenyl-9-[3-(3-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]carbazole (CID 158178481) is 9-[3-(2,7-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-2,7-diphenylcarbazole;9-[3-(3,6-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-3,6-diphenylcarbazole;2-phenyl-9-[3-(2-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(2,4,6-trifluorophenyl)phenyl]carbazole;3-phenyl-9-[3-(3-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]carbazole.
What is the SMILES notation for 9-[3-(2,7-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-2,7-diphenylcarbazole;9-[3-(3,6-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-3,6-diphenylcarbazole;2-phenyl-9-[3-(2-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(2,4,6-trifluorophenyl)phenyl]carbazole;3-phenyl-9-[3-(3-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]carbazole?
The canonical SMILES for 9-[3-(2,7-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-2,7-diphenylcarbazole;9-[3-(3,6-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-3,6-diphenylcarbazole;2-phenyl-9-[3-(2-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(2,4,6-trifluorophenyl)phenyl]carbazole;3-phenyl-9-[3-(3-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]carbazole is Fc1cc(-c2cc(-n3c4cc(-c5ccccc5)ccc4c4ccc(-c5ccccc5)cc43)c(C(F)(F)F)c(-n3c4cc(-c5ccccc5)ccc4c4ccc(-c5ccccc5)cc43)c2)cc(F)c1F.Fc1cc(-c2cc(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc43)c(C(F)(F)F)c(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc43)c2)cc(F)c1F.Fc1cc(-c2cc(-n3c4ccccc4c4cc(-c5ccccc5)ccc43)c(C(F)(F)F)c(-n3c4ccccc4c4cc(-c5ccccc5)ccc43)c2)cc(F)c1F.Fc1cc(F)c(-c2cc(-n3c4ccccc4c4ccc(-c5ccccc5)cc43)c(C(F)(F)F)c(-n3c4ccccc4c4ccc(-c5ccccc5)cc43)c2)c(F)c1.
What is the InChIKey of 9-[3-(2,7-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-2,7-diphenylcarbazole;9-[3-(3,6-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-3,6-diphenylcarbazole;2-phenyl-9-[3-(2-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(2,4,6-trifluorophenyl)phenyl]carbazole;3-phenyl-9-[3-(3-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]carbazole?
The InChIKey is FYHBGOXKDFYWBL-UHFFFAOYSA-N. The full InChI is InChI=1S/2C61H36F6N2.2C49H28F6N2/c62-51-29-45(30-52(63)60(51)64)46-35-57(68-53-31-41(37-13-5-1-6-14-37)21-25-47(53)48-26-22-42(32-54(48)68)38-15-7-2-8-16-38)59(61(65,66)67)58(36-46)69-55-33-43(39-17-9-3-10-18-39)23-27-49(55)50-28-24-44(34-56(50)69)40-19-11-4-12-20-40;62-51-33-45(34-52(63)60(51)64)46-35-57(68-53-25-21-41(37-13-5-1-6-14-37)29-47(53)48-30-42(22-26-54(48)68)38-15-7-2-8-16-38)59(61(65,66)67)58(36-46)69-55-27-23-43(39-17-9-3-10-18-39)31-49(55)50-32-44(24-28-56(50)69)40-19-11-4-12-20-40;50-34-27-39(51)47(40(52)28-34)33-25-45(56-41-17-9-7-15-35(41)37-21-19-31(23-43(37)56)29-11-3-1-4-12-29)48(49(53,54)55)46(26-33)57-42-18-10-8-16-36(42)38-22-20-32(24-44(38)57)30-13-5-2-6-14-30;50-39-25-33(26-40(51)48(39)52)34-27-45(56-41-17-9-7-15-35(41)37-23-31(19-21-43(37)56)29-11-3-1-4-12-29)47(49(53,54)55)46(28-34)57-42-18-10-8-16-36(42)38-24-32(20-22-44(38)57)30-13-5-2-6-14-30/h2*1-36H;2*1-28H.
What are the key properties of 9-[3-(2,7-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-2,7-diphenylcarbazole;9-[3-(3,6-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-3,6-diphenylcarbazole;2-phenyl-9-[3-(2-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(2,4,6-trifluorophenyl)phenyl]carbazole;3-phenyl-9-[3-(3-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]carbazole?
9-[3-(2,7-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-2,7-diphenylcarbazole;9-[3-(3,6-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-3,6-diphenylcarbazole;2-phenyl-9-[3-(2-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(2,4,6-trifluorophenyl)phenyl]carbazole;3-phenyl-9-[3-(3-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]carbazole has a molecular weight of 3339.45 g/mol, XLogP of 63.94, 24 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-(2,7-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-2,7-diphenylcarbazole;9-[3-(3,6-diphenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]-3,6-diphenylcarbazole;2-phenyl-9-[3-(2-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(2,4,6-trifluorophenyl)phenyl]carbazole;3-phenyl-9-[3-(3-phenylcarbazol-9-yl)-2-(trifluoromethyl)-5-(3,4,5-trifluorophenyl)phenyl]carbazole is sourced from PubChem (CID 158178481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).