9-[6-carbazol-9-yl-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]carbazole;9-[6-carbazol-9-yl-9,10-bis(2-methylnaphthalen-1-yl)anthracen-2-yl]carbazole;9-(6-carbazol-9-yl-9,10-dinaphthalen-2-ylanthracen-2-yl)carbazole

C192H124N6 — CID 161048661

IUPAC9-[6-carbazol-9-yl-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]carbazole;9-[6-carbazol-9-yl-9,10-bis(2-methylnaphthalen-1-yl)anthracen-2-yl]carbazole;9-(6-carbazol-9-yl-9,10-dinaphthalen-2-ylanthracen-2-yl)carbazole
SMILESCc1ccc2ccccc2c1-c1c2ccc(-n3c4ccccc4c4ccccc43)cc2c(-c2c(C)ccc3ccccc23)c2ccc(-n3c4ccccc4c4ccccc43)cc12.c1ccc(-c2cc(-c3ccccc3)cc(-c3c4ccc(-n5c6ccccc6c6ccccc65)cc4c(-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)c4ccc(-n5c6ccccc6c6ccccc65)cc34)c2)cc1.c1ccc2cc(-c3c4ccc(-n5c6ccccc6c6ccccc65)cc4c(-c4ccc5ccccc5c4)c4ccc(-n5c6ccccc6c6ccccc65)cc34)ccc2c1
InChIInChI=1S/C74H48N2.C60H40N2.C58H36N2/c1-5-21-49(22-6-1)53-41-54(50-23-7-2-8-24-50)44-57(43-53)73-65-39-37-60(76-71-35-19-15-31-63(71)64-32-16-20-36-72(64)76)48-68(65)74(58-45-55(51-25-9-3-10-26-51)42-56(46-58)52-27-11-4-12-28-52)66-40-38-59(47-67(66)73)75-69-33-17-13-29-61(69)62-30-14-18-34-70(62)75;1-37-27-29-39-15-3-5-17-43(39)57(37)59-49-33-31-42(62-55-25-13-9-21-47(55)48-22-10-14-26-56(48)62)36-52(49)60(58-38(2)28-30-40-16-4-6-18-44(40)58)50-34-32-41(35-51(50)59)61-53-23-11-7-19-45(53)46-20-8-12-24-54(46)61;1-3-15-39-33-41(27-25-37(39)13-1)57-49-31-29-44(60-55-23-11-7-19-47(55)48-20-8-12-24-56(48)60)36-52(49)58(42-28-26-38-14-2-4-16-40(38)34-42)50-32-30-43(35-51(50)57)59-53-21-9-5-17-45(53)46-18-6-10-22-54(46)59/h1-48H;3-36H,1-2H3;1-36H
InChIKeyUBVKHFRLEVTCKY-UHFFFAOYSA-N
MW2515.15 g/mol
LogP52.46
Rot. Bonds16

About 9-[6-carbazol-9-yl-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]carbazole;9-[6-carbazol-9-yl-9,10-bis(2-methylnaphthalen-1-yl)anthracen-2-yl]carbazole;9-(6-carbazol-9-yl-9,10-dinaphthalen-2-ylanthracen-2-yl)carbazole

9-[6-carbazol-9-yl-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]carbazole;9-[6-carbazol-9-yl-9,10-bis(2-methylnaphthalen-1-yl)anthracen-2-yl]carbazole;9-(6-carbazol-9-yl-9,10-dinaphthalen-2-ylanthracen-2-yl)carbazole (PubChem CID 161048661) has the molecular formula C192H124N6 and a molecular weight of 2515.15 g/mol. Its IUPAC name is 9-[6-carbazol-9-yl-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]carbazole;9-[6-carbazol-9-yl-9,10-bis(2-methylnaphthalen-1-yl)anthracen-2-yl]carbazole;9-(6-carbazol-9-yl-9,10-dinaphthalen-2-ylanthracen-2-yl)carbazole.

Molecular Properties

Compound Name9-[6-carbazol-9-yl-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]carbazole;9-[6-carbazol-9-yl-9,10-bis(2-methylnaphthalen-1-yl)anthracen-2-yl]carbazole;9-(6-carbazol-9-yl-9,10-dinaphthalen-2-ylanthracen-2-yl)carbazole
PubChem CID161048661
Molecular FormulaC192H124N6
Molecular Weight2515.15 g/mol
Exact Mass2512.99
IUPAC Name9-[6-carbazol-9-yl-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]carbazole;9-[6-carbazol-9-yl-9,10-bis(2-methylnaphthalen-1-yl)anthracen-2-yl]carbazole;9-(6-carbazol-9-yl-9,10-dinaphthalen-2-ylanthracen-2-yl)carbazole
SMILESCc1ccc2ccccc2c1-c1c2ccc(-n3c4ccccc4c4ccccc43)cc2c(-c2c(C)ccc3ccccc23)c2ccc(-n3c4ccccc4c4ccccc43)cc12.c1ccc(-c2cc(-c3ccccc3)cc(-c3c4ccc(-n5c6ccccc6c6ccccc65)cc4c(-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)c4ccc(-n5c6ccccc6c6ccccc65)cc34)c2)cc1.c1ccc2cc(-c3c4ccc(-n5c6ccccc6c6ccccc65)cc4c(-c4ccc5ccccc5c4)c4ccc(-n5c6ccccc6c6ccccc65)cc34)ccc2c1
InChIInChI=1S/C74H48N2.C60H40N2.C58H36N2/c1-5-21-49(22-6-1)53-41-54(50-23-7-2-8-24-50)44-57(43-53)73-65-39-37-60(76-71-35-19-15-31-63(71)64-32-16-20-36-72(64)76)48-68(65)74(58-45-55(51-25-9-3-10-26-51)42-56(46-58)52-27-11-4-12-28-52)66-40-38-59(47-67(66)73)75-69-33-17-13-29-61(69)62-30-14-18-34-70(62)75;1-37-27-29-39-15-3-5-17-43(39)57(37)59-49-33-31-42(62-55-25-13-9-21-47(55)48-22-10-14-26-56(48)62)36-52(49)60(58-38(2)28-30-40-16-4-6-18-44(40)58)50-34-32-41(35-51(50)59)61-53-23-11-7-19-45(53)46-20-8-12-24-54(46)61;1-3-15-39-33-41(27-25-37(39)13-1)57-49-31-29-44(60-55-23-11-7-19-47(55)48-20-8-12-24-56(48)60)36-52(49)58(42-28-26-38-14-2-4-16-40(38)34-42)50-32-30-43(35-51(50)57)59-53-21-9-5-17-45(53)46-18-6-10-22-54(46)59/h1-48H;3-36H,1-2H3;1-36H
InChIKeyUBVKHFRLEVTCKY-UHFFFAOYSA-N
XLogP52.46
TPSA29.58 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds16
Heavy Atoms198
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002515.15
LogP ≤ 552.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 9-[6-carbazol-9-yl-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]carbazole;9-[6-carbazol-9-yl-9,10-bis(2-methylnaphthalen-1-yl)anthracen-2-yl]carbazole;9-(6-carbazol-9-yl-9,10-dinaphthalen-2-ylanthracen-2-yl)carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-[6-carbazol-9-yl-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]carbazole;9-[6-carbazol-9-yl-9,10-bis(2-methylnaphthalen-1-yl)anthracen-2-yl]carbazole;9-(6-carbazol-9-yl-9,10-dinaphthalen-2-ylanthracen-2-yl)carbazole?
The IUPAC name of 9-[6-carbazol-9-yl-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]carbazole;9-[6-carbazol-9-yl-9,10-bis(2-methylnaphthalen-1-yl)anthracen-2-yl]carbazole;9-(6-carbazol-9-yl-9,10-dinaphthalen-2-ylanthracen-2-yl)carbazole (CID 161048661) is 9-[6-carbazol-9-yl-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]carbazole;9-[6-carbazol-9-yl-9,10-bis(2-methylnaphthalen-1-yl)anthracen-2-yl]carbazole;9-(6-carbazol-9-yl-9,10-dinaphthalen-2-ylanthracen-2-yl)carbazole.
What is the SMILES notation for 9-[6-carbazol-9-yl-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]carbazole;9-[6-carbazol-9-yl-9,10-bis(2-methylnaphthalen-1-yl)anthracen-2-yl]carbazole;9-(6-carbazol-9-yl-9,10-dinaphthalen-2-ylanthracen-2-yl)carbazole?
The canonical SMILES for 9-[6-carbazol-9-yl-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]carbazole;9-[6-carbazol-9-yl-9,10-bis(2-methylnaphthalen-1-yl)anthracen-2-yl]carbazole;9-(6-carbazol-9-yl-9,10-dinaphthalen-2-ylanthracen-2-yl)carbazole is Cc1ccc2ccccc2c1-c1c2ccc(-n3c4ccccc4c4ccccc43)cc2c(-c2c(C)ccc3ccccc23)c2ccc(-n3c4ccccc4c4ccccc43)cc12.c1ccc(-c2cc(-c3ccccc3)cc(-c3c4ccc(-n5c6ccccc6c6ccccc65)cc4c(-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)c4ccc(-n5c6ccccc6c6ccccc65)cc34)c2)cc1.c1ccc2cc(-c3c4ccc(-n5c6ccccc6c6ccccc65)cc4c(-c4ccc5ccccc5c4)c4ccc(-n5c6ccccc6c6ccccc65)cc34)ccc2c1.
What is the InChIKey of 9-[6-carbazol-9-yl-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]carbazole;9-[6-carbazol-9-yl-9,10-bis(2-methylnaphthalen-1-yl)anthracen-2-yl]carbazole;9-(6-carbazol-9-yl-9,10-dinaphthalen-2-ylanthracen-2-yl)carbazole?
The InChIKey is UBVKHFRLEVTCKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H48N2.C60H40N2.C58H36N2/c1-5-21-49(22-6-1)53-41-54(50-23-7-2-8-24-50)44-57(43-53)73-65-39-37-60(76-71-35-19-15-31-63(71)64-32-16-20-36-72(64)76)48-68(65)74(58-45-55(51-25-9-3-10-26-51)42-56(46-58)52-27-11-4-12-28-52)66-40-38-59(47-67(66)73)75-69-33-17-13-29-61(69)62-30-14-18-34-70(62)75;1-37-27-29-39-15-3-5-17-43(39)57(37)59-49-33-31-42(62-55-25-13-9-21-47(55)48-22-10-14-26-56(48)62)36-52(49)60(58-38(2)28-30-40-16-4-6-18-44(40)58)50-34-32-41(35-51(50)59)61-53-23-11-7-19-45(53)46-20-8-12-24-54(46)61;1-3-15-39-33-41(27-25-37(39)13-1)57-49-31-29-44(60-55-23-11-7-19-47(55)48-20-8-12-24-56(48)60)36-52(49)58(42-28-26-38-14-2-4-16-40(38)34-42)50-32-30-43(35-51(50)57)59-53-21-9-5-17-45(53)46-18-6-10-22-54(46)59/h1-48H;3-36H,1-2H3;1-36H.
What are the key properties of 9-[6-carbazol-9-yl-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]carbazole;9-[6-carbazol-9-yl-9,10-bis(2-methylnaphthalen-1-yl)anthracen-2-yl]carbazole;9-(6-carbazol-9-yl-9,10-dinaphthalen-2-ylanthracen-2-yl)carbazole?
9-[6-carbazol-9-yl-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]carbazole;9-[6-carbazol-9-yl-9,10-bis(2-methylnaphthalen-1-yl)anthracen-2-yl]carbazole;9-(6-carbazol-9-yl-9,10-dinaphthalen-2-ylanthracen-2-yl)carbazole has a molecular weight of 2515.15 g/mol, XLogP of 52.46, 16 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[6-carbazol-9-yl-9,10-bis(3,5-diphenylphenyl)anthracen-2-yl]carbazole;9-[6-carbazol-9-yl-9,10-bis(2-methylnaphthalen-1-yl)anthracen-2-yl]carbazole;9-(6-carbazol-9-yl-9,10-dinaphthalen-2-ylanthracen-2-yl)carbazole is sourced from PubChem (CID 161048661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).