12-(3,6-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3,7-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3-phenylquinoxalin-2-yl)-11-triphenylen-2-ylindolo[2,3-a]carbazole

C138H86N12 — CID 159784735

IUPAC12-(3,6-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3,7-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3-phenylquinoxalin-2-yl)-11-triphenylen-2-ylindolo[2,3-a]carbazole
SMILESc1ccc(-c2ccc3nc(-c4ccccc4)c(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)nc3c2)cc1.c1ccc(-c2ccc3nc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)c(-c4ccccc4)nc3c2)cc1.c1ccc(-c2nc3ccccc3nc2-n2c3ccccc3c3ccc4c5ccccc5n(-c5ccc6c7ccccc7c7ccccc7c6c5)c4c32)cc1
InChIInChI=1S/C50H30N4.2C44H28N4/c1-2-14-31(15-3-1)47-50(52-44-23-11-10-22-43(44)51-47)54-46-25-13-9-21-39(46)41-29-28-40-38-20-8-12-24-45(38)53(48(40)49(41)54)32-26-27-37-35-18-5-4-16-33(35)34-17-6-7-19-36(34)42(37)30-32;1-4-14-29(15-5-1)31-24-27-37-38(28-31)45-41(30-16-6-2-7-17-30)44(46-37)48-40-23-13-11-21-34(40)36-26-25-35-33-20-10-12-22-39(33)47(42(35)43(36)48)32-18-8-3-9-19-32;1-4-14-29(15-5-1)31-24-27-37-38(28-31)46-44(41(45-37)30-16-6-2-7-17-30)48-40-23-13-11-21-34(40)36-26-25-35-33-20-10-12-22-39(33)47(42(35)43(36)48)32-18-8-3-9-19-32/h1-30H;2*1-28H
InChIKeyNHUQFSGCZLQDQN-UHFFFAOYSA-N
MW1912.29 g/mol
LogP35.27
Rot. Bonds11

About 12-(3,6-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3,7-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3-phenylquinoxalin-2-yl)-11-triphenylen-2-ylindolo[2,3-a]carbazole

12-(3,6-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3,7-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3-phenylquinoxalin-2-yl)-11-triphenylen-2-ylindolo[2,3-a]carbazole (PubChem CID 159784735) has the molecular formula C138H86N12 and a molecular weight of 1912.29 g/mol. Its IUPAC name is 12-(3,6-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3,7-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3-phenylquinoxalin-2-yl)-11-triphenylen-2-ylindolo[2,3-a]carbazole.

Molecular Properties

Compound Name12-(3,6-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3,7-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3-phenylquinoxalin-2-yl)-11-triphenylen-2-ylindolo[2,3-a]carbazole
PubChem CID159784735
Molecular FormulaC138H86N12
Molecular Weight1912.29 g/mol
Exact Mass1910.71
IUPAC Name12-(3,6-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3,7-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3-phenylquinoxalin-2-yl)-11-triphenylen-2-ylindolo[2,3-a]carbazole
SMILESc1ccc(-c2ccc3nc(-c4ccccc4)c(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)nc3c2)cc1.c1ccc(-c2ccc3nc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)c(-c4ccccc4)nc3c2)cc1.c1ccc(-c2nc3ccccc3nc2-n2c3ccccc3c3ccc4c5ccccc5n(-c5ccc6c7ccccc7c7ccccc7c6c5)c4c32)cc1
InChIInChI=1S/C50H30N4.2C44H28N4/c1-2-14-31(15-3-1)47-50(52-44-23-11-10-22-43(44)51-47)54-46-25-13-9-21-39(46)41-29-28-40-38-20-8-12-24-45(38)53(48(40)49(41)54)32-26-27-37-35-18-5-4-16-33(35)34-17-6-7-19-36(34)42(37)30-32;1-4-14-29(15-5-1)31-24-27-37-38(28-31)45-41(30-16-6-2-7-17-30)44(46-37)48-40-23-13-11-21-34(40)36-26-25-35-33-20-10-12-22-39(33)47(42(35)43(36)48)32-18-8-3-9-19-32;1-4-14-29(15-5-1)31-24-27-37-38(28-31)46-44(41(45-37)30-16-6-2-7-17-30)48-40-23-13-11-21-34(40)36-26-25-35-33-20-10-12-22-39(33)47(42(35)43(36)48)32-18-8-3-9-19-32/h1-30H;2*1-28H
InChIKeyNHUQFSGCZLQDQN-UHFFFAOYSA-N
XLogP35.27
TPSA106.92 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds11
Heavy Atoms150
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001912.29
LogP ≤ 535.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

Analyze 12-(3,6-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3,7-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3-phenylquinoxalin-2-yl)-11-triphenylen-2-ylindolo[2,3-a]carbazole with MolForge

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Related Compounds

11,12-bis(3,6-diphenylquinoxalin-2-yl)indolo[2,3-a]carbazole;11,12-bis(3,7-diphenylquinoxalin-2-yl)indolo[2,3-a]carbazole
CID 161396735
12-(3,7-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3-naphthalen-1-ylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3-naphthalen-2-ylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3-phenylquinoxalin-2-yl)-11-triphenylen-2-ylindolo[2,3-a]carbazole;12-quinoxalin-2-yl-11-triphenylen-2-ylindolo[2,3-a]carbazole
CID 159766459
11-phenyl-8-[9-(3-phenylquinoxalin-2-yl)carbazol-3-yl]benzo[a]carbazole
CID 155114491
2-phenyl-6-(9-phenylcarbazol-3-yl)-9-(3-phenylquinoxalin-2-yl)carbazole;3-phenyl-6-(9-phenylcarbazol-3-yl)-9-(3-phenylquinoxalin-2-yl)carbazole
CID 157299308
15-(2,3-diphenylquinoxalin-6-yl)-12-phenyl-12,15-diazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene
CID 154952670
12-[4-(3-carbazol-9-ylphenyl)phenyl]-11-phenylindolo[2,3-i]phenanthridine
CID 129122894
9-phenyl-3-(4-phenylphenyl)-6-[9-[4-(3-phenylquinoxalin-2-yl)phenyl]carbazol-3-yl]carbazole
CID 59489317
1,2,3-triphenyl-10-(7-phenyltriphenylen-2-yl)pyrrolo[2,3-a]carbazole
CID 118315810
12-(3,7-diphenylquinoxalin-1-ium-1-yl)-11-(3,7-diphenylquinoxalin-2-yl)indolo[2,3-a]carbazole
CID 155639993
11-phenyl-12-(4-phenylphenyl)indolo[2,3-a]carbazole
CID 118501913
9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-2-(2,3-diphenylquinoxalin-6-yl)carbazole
CID 145361898
14-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-3-phenyl-3,15-diazapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16,18,20-decaene
CID 129123341

Frequently Asked Questions

What is the IUPAC name of 12-(3,6-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3,7-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3-phenylquinoxalin-2-yl)-11-triphenylen-2-ylindolo[2,3-a]carbazole?
The IUPAC name of 12-(3,6-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3,7-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3-phenylquinoxalin-2-yl)-11-triphenylen-2-ylindolo[2,3-a]carbazole (CID 159784735) is 12-(3,6-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3,7-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3-phenylquinoxalin-2-yl)-11-triphenylen-2-ylindolo[2,3-a]carbazole.
What is the SMILES notation for 12-(3,6-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3,7-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3-phenylquinoxalin-2-yl)-11-triphenylen-2-ylindolo[2,3-a]carbazole?
The canonical SMILES for 12-(3,6-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3,7-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3-phenylquinoxalin-2-yl)-11-triphenylen-2-ylindolo[2,3-a]carbazole is c1ccc(-c2ccc3nc(-c4ccccc4)c(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)nc3c2)cc1.c1ccc(-c2ccc3nc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)c(-c4ccccc4)nc3c2)cc1.c1ccc(-c2nc3ccccc3nc2-n2c3ccccc3c3ccc4c5ccccc5n(-c5ccc6c7ccccc7c7ccccc7c6c5)c4c32)cc1.
What is the InChIKey of 12-(3,6-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3,7-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3-phenylquinoxalin-2-yl)-11-triphenylen-2-ylindolo[2,3-a]carbazole?
The InChIKey is NHUQFSGCZLQDQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H30N4.2C44H28N4/c1-2-14-31(15-3-1)47-50(52-44-23-11-10-22-43(44)51-47)54-46-25-13-9-21-39(46)41-29-28-40-38-20-8-12-24-45(38)53(48(40)49(41)54)32-26-27-37-35-18-5-4-16-33(35)34-17-6-7-19-36(34)42(37)30-32;1-4-14-29(15-5-1)31-24-27-37-38(28-31)45-41(30-16-6-2-7-17-30)44(46-37)48-40-23-13-11-21-34(40)36-26-25-35-33-20-10-12-22-39(33)47(42(35)43(36)48)32-18-8-3-9-19-32;1-4-14-29(15-5-1)31-24-27-37-38(28-31)46-44(41(45-37)30-16-6-2-7-17-30)48-40-23-13-11-21-34(40)36-26-25-35-33-20-10-12-22-39(33)47(42(35)43(36)48)32-18-8-3-9-19-32/h1-30H;2*1-28H.
What are the key properties of 12-(3,6-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3,7-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3-phenylquinoxalin-2-yl)-11-triphenylen-2-ylindolo[2,3-a]carbazole?
12-(3,6-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3,7-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3-phenylquinoxalin-2-yl)-11-triphenylen-2-ylindolo[2,3-a]carbazole has a molecular weight of 1912.29 g/mol, XLogP of 35.27, 11 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 12-(3,6-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3,7-diphenylquinoxalin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(3-phenylquinoxalin-2-yl)-11-triphenylen-2-ylindolo[2,3-a]carbazole is sourced from PubChem (CID 159784735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).