9-[4-[5-(4-carbazol-9-ylphenyl)-9,10-bis(3-methylphenyl)anthracen-1-yl]phenyl]carbazole;9-[4-[9,10-diphenyl-5-[4-(3-phenylcarbazol-9-yl)phenyl]anthracen-1-yl]phenyl]-3-phenylcarbazole

C138H92N4 — CID 157279460

IUPAC9-[4-[5-(4-carbazol-9-ylphenyl)-9,10-bis(3-methylphenyl)anthracen-1-yl]phenyl]carbazole;9-[4-[9,10-diphenyl-5-[4-(3-phenylcarbazol-9-yl)phenyl]anthracen-1-yl]phenyl]-3-phenylcarbazole
SMILESCc1cccc(-c2c3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c3c(-c3cccc(C)c3)c3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c23)c1.c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3cccc4c(-c5ccccc5)c5c(-c6ccc(-n7c8ccccc8c8cc(-c9ccccc9)ccc87)cc6)cccc5c(-c5ccccc5)c34)cc2)cc1
InChIInChI=1S/C74H48N2.C64H44N2/c1-5-19-49(20-6-1)55-39-45-69-65(47-55)61-27-13-15-33-67(61)75(69)57-41-35-51(36-42-57)59-29-17-31-63-72(54-25-11-4-12-26-54)74-60(30-18-32-64(74)71(73(59)63)53-23-9-3-10-24-53)52-37-43-58(44-38-52)76-68-34-16-14-28-62(68)66-48-56(40-46-70(66)76)50-21-7-2-8-22-50;1-41-15-11-17-45(39-41)61-55-25-13-24-50(44-33-37-48(38-34-44)66-59-29-9-5-21-53(59)54-22-6-10-30-60(54)66)64(55)62(46-18-12-16-42(2)40-46)56-26-14-23-49(63(56)61)43-31-35-47(36-32-43)65-57-27-7-3-19-51(57)52-20-4-8-28-58(52)65/h1-48H;3-40H,1-2H3
InChIKeyAZMJOUBIDKNMQU-UHFFFAOYSA-N
MW1806.28 g/mol
LogP37.66
Rot. Bonds14

About 9-[4-[5-(4-carbazol-9-ylphenyl)-9,10-bis(3-methylphenyl)anthracen-1-yl]phenyl]carbazole;9-[4-[9,10-diphenyl-5-[4-(3-phenylcarbazol-9-yl)phenyl]anthracen-1-yl]phenyl]-3-phenylcarbazole

9-[4-[5-(4-carbazol-9-ylphenyl)-9,10-bis(3-methylphenyl)anthracen-1-yl]phenyl]carbazole;9-[4-[9,10-diphenyl-5-[4-(3-phenylcarbazol-9-yl)phenyl]anthracen-1-yl]phenyl]-3-phenylcarbazole (PubChem CID 157279460) has the molecular formula C138H92N4 and a molecular weight of 1806.28 g/mol. Its IUPAC name is 9-[4-[5-(4-carbazol-9-ylphenyl)-9,10-bis(3-methylphenyl)anthracen-1-yl]phenyl]carbazole;9-[4-[9,10-diphenyl-5-[4-(3-phenylcarbazol-9-yl)phenyl]anthracen-1-yl]phenyl]-3-phenylcarbazole.

Molecular Properties

Compound Name9-[4-[5-(4-carbazol-9-ylphenyl)-9,10-bis(3-methylphenyl)anthracen-1-yl]phenyl]carbazole;9-[4-[9,10-diphenyl-5-[4-(3-phenylcarbazol-9-yl)phenyl]anthracen-1-yl]phenyl]-3-phenylcarbazole
PubChem CID157279460
Molecular FormulaC138H92N4
Molecular Weight1806.28 g/mol
Exact Mass1804.73
IUPAC Name9-[4-[5-(4-carbazol-9-ylphenyl)-9,10-bis(3-methylphenyl)anthracen-1-yl]phenyl]carbazole;9-[4-[9,10-diphenyl-5-[4-(3-phenylcarbazol-9-yl)phenyl]anthracen-1-yl]phenyl]-3-phenylcarbazole
SMILESCc1cccc(-c2c3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c3c(-c3cccc(C)c3)c3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c23)c1.c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3cccc4c(-c5ccccc5)c5c(-c6ccc(-n7c8ccccc8c8cc(-c9ccccc9)ccc87)cc6)cccc5c(-c5ccccc5)c34)cc2)cc1
InChIInChI=1S/C74H48N2.C64H44N2/c1-5-19-49(20-6-1)55-39-45-69-65(47-55)61-27-13-15-33-67(61)75(69)57-41-35-51(36-42-57)59-29-17-31-63-72(54-25-11-4-12-26-54)74-60(30-18-32-64(74)71(73(59)63)53-23-9-3-10-24-53)52-37-43-58(44-38-52)76-68-34-16-14-28-62(68)66-48-56(40-46-70(66)76)50-21-7-2-8-22-50;1-41-15-11-17-45(39-41)61-55-25-13-24-50(44-33-37-48(38-34-44)66-59-29-9-5-21-53(59)54-22-6-10-30-60(54)66)64(55)62(46-18-12-16-42(2)40-46)56-26-14-23-49(63(56)61)43-31-35-47(36-32-43)65-57-27-7-3-19-51(57)52-20-4-8-28-58(52)65/h1-48H;3-40H,1-2H3
InChIKeyAZMJOUBIDKNMQU-UHFFFAOYSA-N
XLogP37.66
TPSA19.72 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms142
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001806.28
LogP ≤ 537.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 9-[4-[5-(4-carbazol-9-ylphenyl)-9,10-bis(3-methylphenyl)anthracen-1-yl]phenyl]carbazole;9-[4-[9,10-diphenyl-5-[4-(3-phenylcarbazol-9-yl)phenyl]anthracen-1-yl]phenyl]-3-phenylcarbazole with MolForge

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Related Compounds

3-[9-[4-[3-(3-methylphenyl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[3-(4-methylphenyl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 160753219
3-(3-phenylphenyl)-9-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]carbazole;3-(3-phenylphenyl)-9-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]carbazole
CID 157065974
5,9-diphenyl-3-(9-phenylcarbazol-3-yl)carbazole;5-phenyl-3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 160685377
5,9-diphenyl-3-(9-phenylcarbazol-3-yl)carbazole;9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 162115946
9-phenyl-5-(4-phenylphenyl)-3-[9-[4-(4-phenylphenyl)phenyl]carbazol-3-yl]carbazole
CID 170073009
9-[4-(3-methylphenyl)phenyl]-14-(4-phenylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 170201895
3-carbazol-9-yl-9-[4-[4-(3-methylphenyl)phenyl]phenyl]carbazole
CID 170198467
9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole;9-[3-(4-methylphenyl)phenyl]carbazole;9-[4-(3-methylphenyl)phenyl]carbazole;9-[4-(4-methylphenyl)phenyl]carbazole
CID 158304172
9-(3-methylphenyl)-3,6-diphenylcarbazole;9-[3-(4-methylphenyl)phenyl]carbazole;9-[4-(3-methylphenyl)phenyl]carbazole;9-[4-(4-methylphenyl)phenyl]carbazole
CID 160614579
9-phenyl-3-(9-phenylcarbazol-3-yl)-5-[4-(4-phenylphenyl)phenyl]carbazole
CID 134369783
9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-4-yl]carbazole
CID 146187387
9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole
CID 162048953

Frequently Asked Questions

What is the IUPAC name of 9-[4-[5-(4-carbazol-9-ylphenyl)-9,10-bis(3-methylphenyl)anthracen-1-yl]phenyl]carbazole;9-[4-[9,10-diphenyl-5-[4-(3-phenylcarbazol-9-yl)phenyl]anthracen-1-yl]phenyl]-3-phenylcarbazole?
The IUPAC name of 9-[4-[5-(4-carbazol-9-ylphenyl)-9,10-bis(3-methylphenyl)anthracen-1-yl]phenyl]carbazole;9-[4-[9,10-diphenyl-5-[4-(3-phenylcarbazol-9-yl)phenyl]anthracen-1-yl]phenyl]-3-phenylcarbazole (CID 157279460) is 9-[4-[5-(4-carbazol-9-ylphenyl)-9,10-bis(3-methylphenyl)anthracen-1-yl]phenyl]carbazole;9-[4-[9,10-diphenyl-5-[4-(3-phenylcarbazol-9-yl)phenyl]anthracen-1-yl]phenyl]-3-phenylcarbazole.
What is the SMILES notation for 9-[4-[5-(4-carbazol-9-ylphenyl)-9,10-bis(3-methylphenyl)anthracen-1-yl]phenyl]carbazole;9-[4-[9,10-diphenyl-5-[4-(3-phenylcarbazol-9-yl)phenyl]anthracen-1-yl]phenyl]-3-phenylcarbazole?
The canonical SMILES for 9-[4-[5-(4-carbazol-9-ylphenyl)-9,10-bis(3-methylphenyl)anthracen-1-yl]phenyl]carbazole;9-[4-[9,10-diphenyl-5-[4-(3-phenylcarbazol-9-yl)phenyl]anthracen-1-yl]phenyl]-3-phenylcarbazole is Cc1cccc(-c2c3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c3c(-c3cccc(C)c3)c3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c23)c1.c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3cccc4c(-c5ccccc5)c5c(-c6ccc(-n7c8ccccc8c8cc(-c9ccccc9)ccc87)cc6)cccc5c(-c5ccccc5)c34)cc2)cc1.
What is the InChIKey of 9-[4-[5-(4-carbazol-9-ylphenyl)-9,10-bis(3-methylphenyl)anthracen-1-yl]phenyl]carbazole;9-[4-[9,10-diphenyl-5-[4-(3-phenylcarbazol-9-yl)phenyl]anthracen-1-yl]phenyl]-3-phenylcarbazole?
The InChIKey is AZMJOUBIDKNMQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H48N2.C64H44N2/c1-5-19-49(20-6-1)55-39-45-69-65(47-55)61-27-13-15-33-67(61)75(69)57-41-35-51(36-42-57)59-29-17-31-63-72(54-25-11-4-12-26-54)74-60(30-18-32-64(74)71(73(59)63)53-23-9-3-10-24-53)52-37-43-58(44-38-52)76-68-34-16-14-28-62(68)66-48-56(40-46-70(66)76)50-21-7-2-8-22-50;1-41-15-11-17-45(39-41)61-55-25-13-24-50(44-33-37-48(38-34-44)66-59-29-9-5-21-53(59)54-22-6-10-30-60(54)66)64(55)62(46-18-12-16-42(2)40-46)56-26-14-23-49(63(56)61)43-31-35-47(36-32-43)65-57-27-7-3-19-51(57)52-20-4-8-28-58(52)65/h1-48H;3-40H,1-2H3.
What are the key properties of 9-[4-[5-(4-carbazol-9-ylphenyl)-9,10-bis(3-methylphenyl)anthracen-1-yl]phenyl]carbazole;9-[4-[9,10-diphenyl-5-[4-(3-phenylcarbazol-9-yl)phenyl]anthracen-1-yl]phenyl]-3-phenylcarbazole?
9-[4-[5-(4-carbazol-9-ylphenyl)-9,10-bis(3-methylphenyl)anthracen-1-yl]phenyl]carbazole;9-[4-[9,10-diphenyl-5-[4-(3-phenylcarbazol-9-yl)phenyl]anthracen-1-yl]phenyl]-3-phenylcarbazole has a molecular weight of 1806.28 g/mol, XLogP of 37.66, 14 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[5-(4-carbazol-9-ylphenyl)-9,10-bis(3-methylphenyl)anthracen-1-yl]phenyl]carbazole;9-[4-[9,10-diphenyl-5-[4-(3-phenylcarbazol-9-yl)phenyl]anthracen-1-yl]phenyl]-3-phenylcarbazole is sourced from PubChem (CID 157279460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).