9-[3-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]-5-[4-[3-(3,5-diphenylphenyl)phenyl]quinazolin-2-yl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole

C134H84N8 — CID 134236954

IUPAC9-[3-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]-5-[4-[3-(3,5-diphenylphenyl)phenyl]quinazolin-2-yl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3cccc(-c4nc(-c5cc(-n6c7ccc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)cc7c7cc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)ccc76)cc(-n6c7ccc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)cc7c7cc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)ccc76)c5)nc5ccccc45)c3)c2)cc1
InChIInChI=1S/C134H84N8/c1-7-30-85(31-8-1)97-71-98(86-32-9-2-10-33-86)73-99(72-97)87-34-29-35-96(70-87)133-111-48-19-24-49-120(111)135-134(136-133)100-74-105(141-129-66-58-92(88-54-62-125-112(76-88)107-44-20-25-50-121(107)137(125)101-36-11-3-12-37-101)80-116(129)117-81-93(59-67-130(117)141)89-55-63-126-113(77-89)108-45-21-26-51-122(108)138(126)102-38-13-4-14-39-102)84-106(75-100)142-131-68-60-94(90-56-64-127-114(78-90)109-46-22-27-52-123(109)139(127)103-40-15-5-16-41-103)82-118(131)119-83-95(61-69-132(119)142)91-57-65-128-115(79-91)110-47-23-28-53-124(110)140(128)104-42-17-6-18-43-104/h1-84H
InChIKeyQTXDSXYMAMQERK-UHFFFAOYSA-N
MW1806.20 g/mol
LogP35.22
Rot. Bonds15

About 9-[3-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]-5-[4-[3-(3,5-diphenylphenyl)phenyl]quinazolin-2-yl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole

9-[3-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]-5-[4-[3-(3,5-diphenylphenyl)phenyl]quinazolin-2-yl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole (PubChem CID 134236954) has the molecular formula C134H84N8 and a molecular weight of 1806.20 g/mol. Its IUPAC name is 9-[3-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]-5-[4-[3-(3,5-diphenylphenyl)phenyl]quinazolin-2-yl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole.

Molecular Properties

Compound Name9-[3-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]-5-[4-[3-(3,5-diphenylphenyl)phenyl]quinazolin-2-yl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole
PubChem CID134236954
Molecular FormulaC134H84N8
Molecular Weight1806.20 g/mol
Exact Mass1804.68
IUPAC Name9-[3-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]-5-[4-[3-(3,5-diphenylphenyl)phenyl]quinazolin-2-yl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3cccc(-c4nc(-c5cc(-n6c7ccc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)cc7c7cc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)ccc76)cc(-n6c7ccc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)cc7c7cc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)ccc76)c5)nc5ccccc45)c3)c2)cc1
InChIInChI=1S/C134H84N8/c1-7-30-85(31-8-1)97-71-98(86-32-9-2-10-33-86)73-99(72-97)87-34-29-35-96(70-87)133-111-48-19-24-49-120(111)135-134(136-133)100-74-105(141-129-66-58-92(88-54-62-125-112(76-88)107-44-20-25-50-121(107)137(125)101-36-11-3-12-37-101)80-116(129)117-81-93(59-67-130(117)141)89-55-63-126-113(77-89)108-45-21-26-51-122(108)138(126)102-38-13-4-14-39-102)84-106(75-100)142-131-68-60-94(90-56-64-127-114(78-90)109-46-22-27-52-123(109)139(127)103-40-15-5-16-41-103)82-118(131)119-83-95(61-69-132(119)142)91-57-65-128-115(79-91)110-47-23-28-53-124(110)140(128)104-42-17-6-18-43-104/h1-84H
InChIKeyQTXDSXYMAMQERK-UHFFFAOYSA-N
XLogP35.22
TPSA55.36 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds15
Heavy Atoms142
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001806.20
LogP ≤ 535.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 9-[3-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]-5-[4-[3-(3,5-diphenylphenyl)phenyl]quinazolin-2-yl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(9-phenylcarbazol-3-yl)-9-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-5-[4-[3-(2-phenylphenyl)phenyl]quinazolin-2-yl]phenyl]carbazole
CID 134236962
3-(9-phenylcarbazol-3-yl)-9-[3-[4-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]quinazolin-2-yl]phenyl]carbazole
CID 121444205
9-phenyl-3-(9-phenylcarbazol-3-yl)-6-[9-[3-[2-[3-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]quinazolin-4-yl]phenyl]carbazol-3-yl]carbazole
CID 122677106
3-[9-[3-[4,6-bis[3-(3,5-diphenylphenyl)phenyl]-1,3,5-triazin-2-yl]-5-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 134237073
3-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]-9-[4-(4-phenylquinazolin-2-yl)phenyl]carbazole
CID 118067271
3-[3,5-bis[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-1-phenylbenzo[f]quinazoline;3-[3,5-bis[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-1-(3-phenylphenyl)benzo[f]quinazoline
CID 158745072
3-(9-phenylcarbazol-2-yl)-9-[3-(4-phenylquinazolin-2-yl)phenyl]carbazole
CID 90129276
9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[3-(3-phenylphenyl)carbazol-9-yl]phenyl]-3-(3-phenylphenyl)carbazole
CID 150934071
3-[4-(9-phenylcarbazol-3-yl)phenyl]-9-[4-(3-phenylphenyl)quinazolin-2-yl]carbazole
CID 118067227
9-[3-[2,6-bis[4-[3,6-bis(9-phenylcarbazol-2-yl)carbazol-9-yl]phenyl]quinazolin-4-yl]phenyl]-3,6-bis(9-phenylcarbazol-2-yl)carbazole
CID 126630568
3-[4-(4-carbazol-9-ylphenyl)quinazolin-2-yl]-9-phenylcarbazole
CID 146435061
3-[3-carbazol-9-yl-5-[6-[3-(4-carbazol-9-ylphenyl)phenyl]-2-(3,5-diphenylphenyl)pyrimidin-4-yl]phenyl]-9-phenylcarbazole;3-[3-carbazol-9-yl-5-[6-[3-(4-carbazol-9-ylphenyl)phenyl]-2-(3-phenylphenyl)pyrimidin-4-yl]phenyl]-9-phenylcarbazole;3-[3-carbazol-9-yl-5-[6-[3-(4-carbazol-9-ylphenyl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]-9-phenylcarbazole
CID 157469186

Frequently Asked Questions

What is the IUPAC name of 9-[3-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]-5-[4-[3-(3,5-diphenylphenyl)phenyl]quinazolin-2-yl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole?
The IUPAC name of 9-[3-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]-5-[4-[3-(3,5-diphenylphenyl)phenyl]quinazolin-2-yl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole (CID 134236954) is 9-[3-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]-5-[4-[3-(3,5-diphenylphenyl)phenyl]quinazolin-2-yl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole.
What is the SMILES notation for 9-[3-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]-5-[4-[3-(3,5-diphenylphenyl)phenyl]quinazolin-2-yl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole?
The canonical SMILES for 9-[3-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]-5-[4-[3-(3,5-diphenylphenyl)phenyl]quinazolin-2-yl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole is c1ccc(-c2cc(-c3ccccc3)cc(-c3cccc(-c4nc(-c5cc(-n6c7ccc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)cc7c7cc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)ccc76)cc(-n6c7ccc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)cc7c7cc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)ccc76)c5)nc5ccccc45)c3)c2)cc1.
What is the InChIKey of 9-[3-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]-5-[4-[3-(3,5-diphenylphenyl)phenyl]quinazolin-2-yl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole?
The InChIKey is QTXDSXYMAMQERK-UHFFFAOYSA-N. The full InChI is InChI=1S/C134H84N8/c1-7-30-85(31-8-1)97-71-98(86-32-9-2-10-33-86)73-99(72-97)87-34-29-35-96(70-87)133-111-48-19-24-49-120(111)135-134(136-133)100-74-105(141-129-66-58-92(88-54-62-125-112(76-88)107-44-20-25-50-121(107)137(125)101-36-11-3-12-37-101)80-116(129)117-81-93(59-67-130(117)141)89-55-63-126-113(77-89)108-45-21-26-51-122(108)138(126)102-38-13-4-14-39-102)84-106(75-100)142-131-68-60-94(90-56-64-127-114(78-90)109-46-22-27-52-123(109)139(127)103-40-15-5-16-41-103)82-118(131)119-83-95(61-69-132(119)142)91-57-65-128-115(79-91)110-47-23-28-53-124(110)140(128)104-42-17-6-18-43-104/h1-84H.
What are the key properties of 9-[3-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]-5-[4-[3-(3,5-diphenylphenyl)phenyl]quinazolin-2-yl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole?
9-[3-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]-5-[4-[3-(3,5-diphenylphenyl)phenyl]quinazolin-2-yl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole has a molecular weight of 1806.20 g/mol, XLogP of 35.22, 15 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]-5-[4-[3-(3,5-diphenylphenyl)phenyl]quinazolin-2-yl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole is sourced from PubChem (CID 134236954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).