3-tert-butyl-6-[4-[4-[10-[4-[4-[6-tert-butyl-9-(3-methylphenyl)carbazol-3-yl]phenyl]phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]phenyl]-9-phenylcarbazole;3-tert-butyl-6-[4-[10-[4-(6-tert-butyl-9-phenylcarbazol-3-yl)phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]-9-phenylcarbazole

C161H138N4 — CID 162186342

IUPAC3-tert-butyl-6-[4-[4-[10-[4-[4-[6-tert-butyl-9-(3-methylphenyl)carbazol-3-yl]phenyl]phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]phenyl]-9-phenylcarbazole;3-tert-butyl-6-[4-[10-[4-(6-tert-butyl-9-phenylcarbazol-3-yl)phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]-9-phenylcarbazole
SMILESCc1cc2c(-c3ccc(-c4ccc5c(c4)c4cc(C(C)(C)C)ccc4n5-c4ccccc4)cc3)c3cc(C)c(C)cc3c(-c3ccc(-c4ccc5c(c4)c4cc(C(C)(C)C)ccc4n5-c4ccccc4)cc3)c2cc1C.Cc1cccc(-n2c3ccc(-c4ccc(-c5ccc(-c6c7cc(C)c(C)cc7c(-c7ccc(-c8ccc(-c9ccc%10c(c9)c9cc(C(C)(C)C)ccc9n%10-c9ccccc9)cc8)cc7)c7cc(C)c(C)cc67)cc5)cc4)cc3c3cc(C(C)(C)C)ccc32)c1
InChIInChI=1S/C87H74N2.C74H64N2/c1-53-16-15-19-71(44-53)89-81-41-37-67(50-73(81)75-52-69(87(9,10)11)39-43-83(75)89)63-26-22-59(23-27-63)61-30-34-65(35-31-61)85-78-47-56(4)54(2)45-76(78)84(77-46-55(3)57(5)48-79(77)85)64-32-28-60(29-33-64)58-20-24-62(25-21-58)66-36-40-80-72(49-66)74-51-68(86(6,7)8)38-42-82(74)88(80)70-17-13-12-14-18-70;1-45-37-63-64(38-46(45)2)72(52-27-23-50(24-28-52)54-30-34-68-60(42-54)62-44-56(74(8,9)10)32-36-70(62)76(68)58-19-15-12-16-20-58)66-40-48(4)47(3)39-65(66)71(63)51-25-21-49(22-26-51)53-29-33-67-59(41-53)61-43-55(73(5,6)7)31-35-69(61)75(67)57-17-13-11-14-18-57/h12-52H,1-11H3;11-44H,1-10H3
InChIKeyZPRWBKBHYXRUNB-UHFFFAOYSA-N
MW2128.90 g/mol
LogP45.01
Rot. Bonds14

About 3-tert-butyl-6-[4-[4-[10-[4-[4-[6-tert-butyl-9-(3-methylphenyl)carbazol-3-yl]phenyl]phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]phenyl]-9-phenylcarbazole;3-tert-butyl-6-[4-[10-[4-(6-tert-butyl-9-phenylcarbazol-3-yl)phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]-9-phenylcarbazole

3-tert-butyl-6-[4-[4-[10-[4-[4-[6-tert-butyl-9-(3-methylphenyl)carbazol-3-yl]phenyl]phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]phenyl]-9-phenylcarbazole;3-tert-butyl-6-[4-[10-[4-(6-tert-butyl-9-phenylcarbazol-3-yl)phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]-9-phenylcarbazole (PubChem CID 162186342) has the molecular formula C161H138N4 and a molecular weight of 2128.90 g/mol. Its IUPAC name is 3-tert-butyl-6-[4-[4-[10-[4-[4-[6-tert-butyl-9-(3-methylphenyl)carbazol-3-yl]phenyl]phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]phenyl]-9-phenylcarbazole;3-tert-butyl-6-[4-[10-[4-(6-tert-butyl-9-phenylcarbazol-3-yl)phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]-9-phenylcarbazole.

Molecular Properties

Compound Name3-tert-butyl-6-[4-[4-[10-[4-[4-[6-tert-butyl-9-(3-methylphenyl)carbazol-3-yl]phenyl]phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]phenyl]-9-phenylcarbazole;3-tert-butyl-6-[4-[10-[4-(6-tert-butyl-9-phenylcarbazol-3-yl)phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]-9-phenylcarbazole
PubChem CID162186342
Molecular FormulaC161H138N4
Molecular Weight2128.90 g/mol
Exact Mass2127.09
IUPAC Name3-tert-butyl-6-[4-[4-[10-[4-[4-[6-tert-butyl-9-(3-methylphenyl)carbazol-3-yl]phenyl]phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]phenyl]-9-phenylcarbazole;3-tert-butyl-6-[4-[10-[4-(6-tert-butyl-9-phenylcarbazol-3-yl)phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]-9-phenylcarbazole
SMILESCc1cc2c(-c3ccc(-c4ccc5c(c4)c4cc(C(C)(C)C)ccc4n5-c4ccccc4)cc3)c3cc(C)c(C)cc3c(-c3ccc(-c4ccc5c(c4)c4cc(C(C)(C)C)ccc4n5-c4ccccc4)cc3)c2cc1C.Cc1cccc(-n2c3ccc(-c4ccc(-c5ccc(-c6c7cc(C)c(C)cc7c(-c7ccc(-c8ccc(-c9ccc%10c(c9)c9cc(C(C)(C)C)ccc9n%10-c9ccccc9)cc8)cc7)c7cc(C)c(C)cc67)cc5)cc4)cc3c3cc(C(C)(C)C)ccc32)c1
InChIInChI=1S/C87H74N2.C74H64N2/c1-53-16-15-19-71(44-53)89-81-41-37-67(50-73(81)75-52-69(87(9,10)11)39-43-83(75)89)63-26-22-59(23-27-63)61-30-34-65(35-31-61)85-78-47-56(4)54(2)45-76(78)84(77-46-55(3)57(5)48-79(77)85)64-32-28-60(29-33-64)58-20-24-62(25-21-58)66-36-40-80-72(49-66)74-51-68(86(6,7)8)38-42-82(74)88(80)70-17-13-12-14-18-70;1-45-37-63-64(38-46(45)2)72(52-27-23-50(24-28-52)54-30-34-68-60(42-54)62-44-56(74(8,9)10)32-36-70(62)76(68)58-19-15-12-16-20-58)66-40-48(4)47(3)39-65(66)71(63)51-25-21-49(22-26-51)53-29-33-67-59(41-53)61-43-55(73(5,6)7)31-35-69(61)75(67)57-17-13-11-14-18-57/h12-52H,1-11H3;11-44H,1-10H3
InChIKeyZPRWBKBHYXRUNB-UHFFFAOYSA-N
XLogP45.01
TPSA19.72 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms165
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002128.90
LogP ≤ 545.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 3-tert-butyl-6-[4-[4-[10-[4-[4-[6-tert-butyl-9-(3-methylphenyl)carbazol-3-yl]phenyl]phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]phenyl]-9-phenylcarbazole;3-tert-butyl-6-[4-[10-[4-(6-tert-butyl-9-phenylcarbazol-3-yl)phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]-9-phenylcarbazole with MolForge

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Related Compounds

3-tert-butyl-6-[4-[4-(2,6-ditert-butyl-10-phenylanthracen-9-yl)phenyl]phenyl]-9-phenylcarbazole;3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]phenyl]-9-phenylcarbazole
CID 161415057
3,6-ditert-butyl-9-[6-(3,6-ditert-butylcarbazol-9-yl)-9,10-bis(3-phenylphenyl)anthracen-2-yl]carbazole;3,6-ditert-butyl-9-[6-(3,6-ditert-butylcarbazol-9-yl)-9,10-bis(4-phenylphenyl)anthracen-2-yl]carbazole
CID 157143874
3-(4-tert-butyl-2-methylphenyl)-6-[6-[6-(4-tert-butylphenyl)-9-phenylcarbazol-3-yl]-9,10-diphenylanthracen-2-yl]-9-phenylcarbazole
CID 90068525
9-(4-tert-butylphenyl)-3,6-di(carbazol-9-yl)carbazole;3,6-di(carbazol-9-yl)-9-(3-methylphenyl)carbazole;3,6-di(carbazol-9-yl)-9-(3-phenylphenyl)carbazole
CID 161086909
9-[3-[3-tert-butyl-10-(4-methylphenyl)anthracen-9-yl]phenyl]carbazole
CID 58991842
3,6-ditert-butyl-9-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]carbazole
CID 59844594
3-methyl-6-[6-methyl-9-(3-methylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 174182038
9-[4-[3-tert-butyl-10-(4-methylphenyl)anthracen-9-yl]phenyl]-3-phenylcarbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]-3-(2-phenylphenyl)carbazole
CID 162176343
9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole
CID 162048953
3,6-ditert-butyl-9-[6-(3,6-ditert-butylcarbazol-9-yl)-9,10-bis(2-methylphenyl)anthracen-2-yl]carbazole;3,6-ditert-butyl-9-[6-(3,6-ditert-butylcarbazol-9-yl)-9,10-bis(3-methylphenyl)anthracen-2-yl]carbazole
CID 160622182
3,6-ditert-butyl-9-[3-[3-(3,6-ditert-butylcarbazol-9-yl)phenyl]phenyl]carbazole;9-[3-[3-(3,6-difluorocarbazol-9-yl)phenyl]phenyl]-3,6-difluorocarbazole;9-[3-[3-(3,6-diphenylcarbazol-9-yl)phenyl]phenyl]-3,6-diphenylcarbazole
CID 158767431
9-[4-(2-tert-butyl-10-phenylanthracen-9-yl)phenyl]-3-naphthalen-2-ylcarbazole;3-naphthalen-1-yl-9-[4-(2,3,6,7-tetramethyl-10-phenylanthracen-9-yl)phenyl]carbazole;3-naphthalen-2-yl-9-[4-(2,3,6,7-tetramethyl-10-phenylanthracen-9-yl)phenyl]carbazole
CID 161107291

Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-6-[4-[4-[10-[4-[4-[6-tert-butyl-9-(3-methylphenyl)carbazol-3-yl]phenyl]phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]phenyl]-9-phenylcarbazole;3-tert-butyl-6-[4-[10-[4-(6-tert-butyl-9-phenylcarbazol-3-yl)phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]-9-phenylcarbazole?
The IUPAC name of 3-tert-butyl-6-[4-[4-[10-[4-[4-[6-tert-butyl-9-(3-methylphenyl)carbazol-3-yl]phenyl]phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]phenyl]-9-phenylcarbazole;3-tert-butyl-6-[4-[10-[4-(6-tert-butyl-9-phenylcarbazol-3-yl)phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]-9-phenylcarbazole (CID 162186342) is 3-tert-butyl-6-[4-[4-[10-[4-[4-[6-tert-butyl-9-(3-methylphenyl)carbazol-3-yl]phenyl]phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]phenyl]-9-phenylcarbazole;3-tert-butyl-6-[4-[10-[4-(6-tert-butyl-9-phenylcarbazol-3-yl)phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]-9-phenylcarbazole.
What is the SMILES notation for 3-tert-butyl-6-[4-[4-[10-[4-[4-[6-tert-butyl-9-(3-methylphenyl)carbazol-3-yl]phenyl]phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]phenyl]-9-phenylcarbazole;3-tert-butyl-6-[4-[10-[4-(6-tert-butyl-9-phenylcarbazol-3-yl)phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]-9-phenylcarbazole?
The canonical SMILES for 3-tert-butyl-6-[4-[4-[10-[4-[4-[6-tert-butyl-9-(3-methylphenyl)carbazol-3-yl]phenyl]phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]phenyl]-9-phenylcarbazole;3-tert-butyl-6-[4-[10-[4-(6-tert-butyl-9-phenylcarbazol-3-yl)phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]-9-phenylcarbazole is Cc1cc2c(-c3ccc(-c4ccc5c(c4)c4cc(C(C)(C)C)ccc4n5-c4ccccc4)cc3)c3cc(C)c(C)cc3c(-c3ccc(-c4ccc5c(c4)c4cc(C(C)(C)C)ccc4n5-c4ccccc4)cc3)c2cc1C.Cc1cccc(-n2c3ccc(-c4ccc(-c5ccc(-c6c7cc(C)c(C)cc7c(-c7ccc(-c8ccc(-c9ccc%10c(c9)c9cc(C(C)(C)C)ccc9n%10-c9ccccc9)cc8)cc7)c7cc(C)c(C)cc67)cc5)cc4)cc3c3cc(C(C)(C)C)ccc32)c1.
What is the InChIKey of 3-tert-butyl-6-[4-[4-[10-[4-[4-[6-tert-butyl-9-(3-methylphenyl)carbazol-3-yl]phenyl]phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]phenyl]-9-phenylcarbazole;3-tert-butyl-6-[4-[10-[4-(6-tert-butyl-9-phenylcarbazol-3-yl)phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]-9-phenylcarbazole?
The InChIKey is ZPRWBKBHYXRUNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C87H74N2.C74H64N2/c1-53-16-15-19-71(44-53)89-81-41-37-67(50-73(81)75-52-69(87(9,10)11)39-43-83(75)89)63-26-22-59(23-27-63)61-30-34-65(35-31-61)85-78-47-56(4)54(2)45-76(78)84(77-46-55(3)57(5)48-79(77)85)64-32-28-60(29-33-64)58-20-24-62(25-21-58)66-36-40-80-72(49-66)74-51-68(86(6,7)8)38-42-82(74)88(80)70-17-13-12-14-18-70;1-45-37-63-64(38-46(45)2)72(52-27-23-50(24-28-52)54-30-34-68-60(42-54)62-44-56(74(8,9)10)32-36-70(62)76(68)58-19-15-12-16-20-58)66-40-48(4)47(3)39-65(66)71(63)51-25-21-49(22-26-51)53-29-33-67-59(41-53)61-43-55(73(5,6)7)31-35-69(61)75(67)57-17-13-11-14-18-57/h12-52H,1-11H3;11-44H,1-10H3.
What are the key properties of 3-tert-butyl-6-[4-[4-[10-[4-[4-[6-tert-butyl-9-(3-methylphenyl)carbazol-3-yl]phenyl]phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]phenyl]-9-phenylcarbazole;3-tert-butyl-6-[4-[10-[4-(6-tert-butyl-9-phenylcarbazol-3-yl)phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]-9-phenylcarbazole?
3-tert-butyl-6-[4-[4-[10-[4-[4-[6-tert-butyl-9-(3-methylphenyl)carbazol-3-yl]phenyl]phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]phenyl]-9-phenylcarbazole;3-tert-butyl-6-[4-[10-[4-(6-tert-butyl-9-phenylcarbazol-3-yl)phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]-9-phenylcarbazole has a molecular weight of 2128.90 g/mol, XLogP of 45.01, 14 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tert-butyl-6-[4-[4-[10-[4-[4-[6-tert-butyl-9-(3-methylphenyl)carbazol-3-yl]phenyl]phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]phenyl]-9-phenylcarbazole;3-tert-butyl-6-[4-[10-[4-(6-tert-butyl-9-phenylcarbazol-3-yl)phenyl]-2,3,6,7-tetramethylanthracen-9-yl]phenyl]-9-phenylcarbazole is sourced from PubChem (CID 162186342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).