3-[9-(3-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(4-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-(3-triphenylen-2-ylphenyl)carbazole

C180H114N6 — CID 158289960

IUPAC3-[9-(3-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(4-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-(3-triphenylen-2-ylphenyl)carbazole
SMILESc1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(-c6cc7ccc8ccccc8c7c7ccccc67)cc5)ccc43)c2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6cc7ccc8ccccc8c7c7ccccc67)c5)ccc43)c2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6ccc7c8ccccc8c8ccccc8c7c6)c5)ccc43)c2)cc1
InChIInChI=1S/3C60H38N2/c1-2-14-39(15-3-1)40-16-12-18-45(34-40)61-57-26-10-8-24-52(57)55-37-43(29-32-59(55)61)44-30-33-60-56(38-44)53-25-9-11-27-58(53)62(60)46-19-13-17-41(35-46)42-28-31-51-49-22-5-4-20-47(49)48-21-6-7-23-50(48)54(51)36-42;1-2-14-39(15-3-1)41-17-12-19-46(34-41)61-56-26-10-8-23-50(56)54-36-42(30-32-58(54)61)43-31-33-59-55(37-43)51-24-9-11-27-57(51)62(59)47-20-13-18-44(35-47)53-38-45-29-28-40-16-4-5-21-48(40)60(45)52-25-7-6-22-49(52)53;1-2-13-39(14-3-1)42-16-12-17-47(35-42)62-57-24-11-9-21-51(57)55-37-44(30-34-59(55)62)43-29-33-58-54(36-43)50-20-8-10-23-56(50)61(58)46-31-27-41(28-32-46)53-38-45-26-25-40-15-4-5-18-48(40)60(45)52-22-7-6-19-49(52)53/h3*1-38H
InChIKeyGLFQYMCGYCYJMO-UHFFFAOYSA-N
MW2360.93 g/mol
LogP49.02
Rot. Bonds15

About 3-[9-(3-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(4-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-(3-triphenylen-2-ylphenyl)carbazole

3-[9-(3-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(4-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-(3-triphenylen-2-ylphenyl)carbazole (PubChem CID 158289960) has the molecular formula C180H114N6 and a molecular weight of 2360.93 g/mol. Its IUPAC name is 3-[9-(3-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(4-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-(3-triphenylen-2-ylphenyl)carbazole.

Molecular Properties

Compound Name3-[9-(3-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(4-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-(3-triphenylen-2-ylphenyl)carbazole
PubChem CID158289960
Molecular FormulaC180H114N6
Molecular Weight2360.93 g/mol
Exact Mass2358.91
IUPAC Name3-[9-(3-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(4-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-(3-triphenylen-2-ylphenyl)carbazole
SMILESc1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(-c6cc7ccc8ccccc8c7c7ccccc67)cc5)ccc43)c2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6cc7ccc8ccccc8c7c7ccccc67)c5)ccc43)c2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6ccc7c8ccccc8c8ccccc8c7c6)c5)ccc43)c2)cc1
InChIInChI=1S/3C60H38N2/c1-2-14-39(15-3-1)40-16-12-18-45(34-40)61-57-26-10-8-24-52(57)55-37-43(29-32-59(55)61)44-30-33-60-56(38-44)53-25-9-11-27-58(53)62(60)46-19-13-17-41(35-46)42-28-31-51-49-22-5-4-20-47(49)48-21-6-7-23-50(48)54(51)36-42;1-2-14-39(15-3-1)41-17-12-19-46(34-41)61-56-26-10-8-23-50(56)54-36-42(30-32-58(54)61)43-31-33-59-55(37-43)51-24-9-11-27-57(51)62(59)47-20-13-18-44(35-47)53-38-45-29-28-40-16-4-5-21-48(40)60(45)52-25-7-6-22-49(52)53;1-2-13-39(14-3-1)42-16-12-17-47(35-42)62-57-24-11-9-21-51(57)55-37-44(30-34-59(55)62)43-29-33-58-54(36-43)50-20-8-10-23-56(50)61(58)46-31-27-41(28-32-46)53-38-45-26-25-40-15-4-5-18-48(40)60(45)52-22-7-6-19-49(52)53/h3*1-38H
InChIKeyGLFQYMCGYCYJMO-UHFFFAOYSA-N
XLogP49.02
TPSA29.58 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds15
Heavy Atoms186
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002360.93
LogP ≤ 549.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

3-[9-(4-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-(9-naphthalen-1-ylcarbazol-3-yl)-9-(3-triphenylen-2-ylphenyl)carbazole
CID 162053455
3-(9-benzo[c]phenanthren-5-ylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole
CID 157485018
9-(9-phenylcarbazol-3-yl)-12-[4-(9-phenylcarbazol-3-yl)phenyl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
CID 121246572
3-[9-(3-naphthalen-1-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-1-ylphenyl)carbazol-3-yl]-9-phenylcarbazole
CID 159770105
3,9-bis(4-naphthalen-1-ylphenyl)carbazole;3-(4-naphthalen-1-ylphenyl)-9-(3-phenylphenyl)carbazole
CID 157309871
2-(4-chrysen-6-ylphenyl)-9-phenyl-6-(21-phenyl-10-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8(13),9,11,15,17,19,21-undecaenyl)carbazole
CID 137458851
2-(9-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)-9-phenylcarbazole
CID 121287520
3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-[3-(4-phenylphenyl)phenyl]carbazole;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole
CID 164968359
3-(9-naphthalen-2-ylcarbazol-3-yl)-9-[3-(2-phenylphenyl)phenyl]carbazole;3-(9-naphthalen-2-ylcarbazol-3-yl)-9-[4-(3-phenylphenyl)phenyl]carbazole
CID 165109371
12-phenyl-7-(9-phenylcarbazol-3-yl)-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaene
CID 121246518
3-[9-(3-naphthalen-1-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[3-(3-phenylphenyl)phenyl]carbazole
CID 159858070
3,6-diphenyl-9-[3-[3-(3-triphenylen-2-ylphenyl)phenyl]phenyl]carbazole;3-phenyl-9-[3-[3-(3-triphenylen-2-ylphenyl)phenyl]phenyl]carbazole
CID 160984322

Frequently Asked Questions

What is the IUPAC name of 3-[9-(3-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(4-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-(3-triphenylen-2-ylphenyl)carbazole?
The IUPAC name of 3-[9-(3-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(4-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-(3-triphenylen-2-ylphenyl)carbazole (CID 158289960) is 3-[9-(3-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(4-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-(3-triphenylen-2-ylphenyl)carbazole.
What is the SMILES notation for 3-[9-(3-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(4-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-(3-triphenylen-2-ylphenyl)carbazole?
The canonical SMILES for 3-[9-(3-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(4-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-(3-triphenylen-2-ylphenyl)carbazole is c1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(-c6cc7ccc8ccccc8c7c7ccccc67)cc5)ccc43)c2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6cc7ccc8ccccc8c7c7ccccc67)c5)ccc43)c2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6ccc7c8ccccc8c8ccccc8c7c6)c5)ccc43)c2)cc1.
What is the InChIKey of 3-[9-(3-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(4-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-(3-triphenylen-2-ylphenyl)carbazole?
The InChIKey is GLFQYMCGYCYJMO-UHFFFAOYSA-N. The full InChI is InChI=1S/3C60H38N2/c1-2-14-39(15-3-1)40-16-12-18-45(34-40)61-57-26-10-8-24-52(57)55-37-43(29-32-59(55)61)44-30-33-60-56(38-44)53-25-9-11-27-58(53)62(60)46-19-13-17-41(35-46)42-28-31-51-49-22-5-4-20-47(49)48-21-6-7-23-50(48)54(51)36-42;1-2-14-39(15-3-1)41-17-12-19-46(34-41)61-56-26-10-8-23-50(56)54-36-42(30-32-58(54)61)43-31-33-59-55(37-43)51-24-9-11-27-57(51)62(59)47-20-13-18-44(35-47)53-38-45-29-28-40-16-4-5-21-48(40)60(45)52-25-7-6-22-49(52)53;1-2-13-39(14-3-1)42-16-12-17-47(35-42)62-57-24-11-9-21-51(57)55-37-44(30-34-59(55)62)43-29-33-58-54(36-43)50-20-8-10-23-56(50)61(58)46-31-27-41(28-32-46)53-38-45-26-25-40-15-4-5-18-48(40)60(45)52-22-7-6-19-49(52)53/h3*1-38H.
What are the key properties of 3-[9-(3-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(4-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-(3-triphenylen-2-ylphenyl)carbazole?
3-[9-(3-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(4-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-(3-triphenylen-2-ylphenyl)carbazole has a molecular weight of 2360.93 g/mol, XLogP of 49.02, 15 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[9-(3-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(4-benzo[c]phenanthren-5-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-(3-triphenylen-2-ylphenyl)carbazole is sourced from PubChem (CID 158289960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).