5-[3-[3-[6-[9-[4-[2,7-bis(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-cyano-2-(3,5-difluorophenyl)phenyl]-7-(6-phenyl-2-pyridinyl)carbazol-2-yl]-2-phenyl-3-pyridinyl]-5-phenylphenyl]carbazol-9-yl]-4-(3,5-difluorophenyl)-2-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]benzonitrile

C141H83F4N11 — CID 154959912

IUPAC5-[3-[3-[6-[9-[4-[2,7-bis(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-cyano-2-(3,5-difluorophenyl)phenyl]-7-(6-phenyl-2-pyridinyl)carbazol-2-yl]-2-phenyl-3-pyridinyl]-5-phenylphenyl]carbazol-9-yl]-4-(3,5-difluorophenyl)-2-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]benzonitrile
SMILESN#Cc1cc(-n2c3ccccc3c3cc(-c4cc(-c5ccccc5)cc(-c5ccc(-c6ccc7c8ccc(-c9cccc(-c%10ccccc%10)n9)cc8n(-c8cc(C#N)c(-n9c%10cc(-c%11cccc(-c%12ccccc%12)n%11)ccc%10c%10ccc(-c%11cccc(-c%12ccccc%12)n%11)cc%109)cc8-c8cc(F)cc(F)c8)c7c6)nc5-c5ccccc5)c4)ccc32)c(-c2cc(F)cc(F)c2)cc1-n1c2ccccc2c2cc(-c3cccc(-c4ccccc4)n3)ccc21
InChIInChI=1S/C141H83F4N11/c142-105-68-101(69-106(143)80-105)116-82-133(153-129-49-21-19-40-111(129)119-73-93(56-64-131(119)153)124-45-23-41-120(148-124)87-29-9-2-10-30-87)103(84-146)78-139(116)154-130-50-22-20-39-110(130)118-72-92(55-63-132(118)154)99-65-98(86-27-7-1-8-28-86)66-100(67-99)109-61-62-128(152-141(109)91-37-17-6-18-38-91)97-54-60-115-114-59-53-96(127-48-26-44-123(151-127)90-35-15-5-16-36-90)76-137(114)156(138(115)77-97)140-79-104(85-147)134(83-117(140)102-70-107(144)81-108(145)71-102)155-135-74-94(125-46-24-42-121(149-125)88-31-11-3-12-32-88)51-57-112(135)113-58-52-95(75-136(113)155)126-47-25-43-122(150-126)89-33-13-4-14-34-89/h1-83H
InChIKeySJVIZUUINGZIFH-UHFFFAOYSA-N
MW2007.28 g/mol
LogP36.35
Rot. Bonds19

About 5-[3-[3-[6-[9-[4-[2,7-bis(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-cyano-2-(3,5-difluorophenyl)phenyl]-7-(6-phenyl-2-pyridinyl)carbazol-2-yl]-2-phenyl-3-pyridinyl]-5-phenylphenyl]carbazol-9-yl]-4-(3,5-difluorophenyl)-2-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]benzonitrile

5-[3-[3-[6-[9-[4-[2,7-bis(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-cyano-2-(3,5-difluorophenyl)phenyl]-7-(6-phenyl-2-pyridinyl)carbazol-2-yl]-2-phenyl-3-pyridinyl]-5-phenylphenyl]carbazol-9-yl]-4-(3,5-difluorophenyl)-2-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]benzonitrile (PubChem CID 154959912) has the molecular formula C141H83F4N11 and a molecular weight of 2007.28 g/mol. Its IUPAC name is 5-[3-[3-[6-[9-[4-[2,7-bis(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-cyano-2-(3,5-difluorophenyl)phenyl]-7-(6-phenyl-2-pyridinyl)carbazol-2-yl]-2-phenyl-3-pyridinyl]-5-phenylphenyl]carbazol-9-yl]-4-(3,5-difluorophenyl)-2-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]benzonitrile.

Molecular Properties

Compound Name5-[3-[3-[6-[9-[4-[2,7-bis(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-cyano-2-(3,5-difluorophenyl)phenyl]-7-(6-phenyl-2-pyridinyl)carbazol-2-yl]-2-phenyl-3-pyridinyl]-5-phenylphenyl]carbazol-9-yl]-4-(3,5-difluorophenyl)-2-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]benzonitrile
PubChem CID154959912
Molecular FormulaC141H83F4N11
Molecular Weight2007.28 g/mol
Exact Mass2005.68
IUPAC Name5-[3-[3-[6-[9-[4-[2,7-bis(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-cyano-2-(3,5-difluorophenyl)phenyl]-7-(6-phenyl-2-pyridinyl)carbazol-2-yl]-2-phenyl-3-pyridinyl]-5-phenylphenyl]carbazol-9-yl]-4-(3,5-difluorophenyl)-2-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]benzonitrile
SMILESN#Cc1cc(-n2c3ccccc3c3cc(-c4cc(-c5ccccc5)cc(-c5ccc(-c6ccc7c8ccc(-c9cccc(-c%10ccccc%10)n9)cc8n(-c8cc(C#N)c(-n9c%10cc(-c%11cccc(-c%12ccccc%12)n%11)ccc%10c%10ccc(-c%11cccc(-c%12ccccc%12)n%11)cc%109)cc8-c8cc(F)cc(F)c8)c7c6)nc5-c5ccccc5)c4)ccc32)c(-c2cc(F)cc(F)c2)cc1-n1c2ccccc2c2cc(-c3cccc(-c4ccccc4)n3)ccc21
InChIInChI=1S/C141H83F4N11/c142-105-68-101(69-106(143)80-105)116-82-133(153-129-49-21-19-40-111(129)119-73-93(56-64-131(119)153)124-45-23-41-120(148-124)87-29-9-2-10-30-87)103(84-146)78-139(116)154-130-50-22-20-39-110(130)118-72-92(55-63-132(118)154)99-65-98(86-27-7-1-8-28-86)66-100(67-99)109-61-62-128(152-141(109)91-37-17-6-18-38-91)97-54-60-115-114-59-53-96(127-48-26-44-123(151-127)90-35-15-5-16-36-90)76-137(114)156(138(115)77-97)140-79-104(85-147)134(83-117(140)102-70-107(144)81-108(145)71-102)155-135-74-94(125-46-24-42-121(149-125)88-31-11-3-12-32-88)51-57-112(135)113-58-52-95(75-136(113)155)126-47-25-43-122(150-126)89-33-13-4-14-34-89/h1-83H
InChIKeySJVIZUUINGZIFH-UHFFFAOYSA-N
XLogP36.35
TPSA131.75 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds19
Heavy Atoms156
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002007.28
LogP ≤ 536.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 5-[3-[3-[6-[9-[4-[2,7-bis(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-cyano-2-(3,5-difluorophenyl)phenyl]-7-(6-phenyl-2-pyridinyl)carbazol-2-yl]-2-phenyl-3-pyridinyl]-5-phenylphenyl]carbazol-9-yl]-4-(3,5-difluorophenyl)-2-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]benzonitrile 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

2,5-bis[2-(6-phenyl-2-pyridinyl)carbazol-9-yl]-4-[3-(trifluoromethyl)phenyl]benzonitrile
CID 142501945
4-(3-isocyanophenyl)-2,5-bis[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]benzonitrile
CID 155647013
5-[9-[2-cyano-4-[3-(3,5-dicyanophenyl)carbazol-9-yl]-5-(6-phenyl-2-pyridinyl)phenyl]carbazol-3-yl]benzene-1,3-dicarbonitrile
CID 155216463
2,5-bis[2,7-bis(6-phenyl-2-pyridinyl)carbazol-9-yl]-4-(2,3,4,5,6-pentafluorophenyl)benzonitrile
CID 154959693
4-[3-cyano-5-(trifluoromethyl)phenyl]-2,5-bis[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]benzonitrile
CID 137386762
2,5-bis[3-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-9-yl]-4-(6-phenyl-2-pyridinyl)benzonitrile
CID 155216461
4-(3,5-difluorophenyl)-2,5-bis(3-pyrimidin-2-ylcarbazol-9-yl)benzonitrile
CID 148646626
2-(3,5-difluorophenyl)-4,5-bis(3,6-diphenylcarbazol-9-yl)benzonitrile
CID 154959925
2-[2,7-bis(3-methylphenyl)carbazol-9-yl]-5-[4-[9-[2-cyano-5-(2,6-diphenyl-4-pyridinyl)-4-[3-(3-methylphenyl)carbazol-9-yl]phenyl]-6-(3-methylphenyl)carbazol-3-yl]-2,7-bis(3-methylphenyl)carbazol-9-yl]-4-(2,6-dimethyl-4-pyridinyl)benzonitrile
CID 134302051
4,5-bis[2-(4-cyanophenyl)carbazol-9-yl]-2-(6-phenyl-2-pyridinyl)benzonitrile
CID 155216774
2,6-bis[2,7-bis(2-phenyl-4-pyridinyl)carbazol-9-yl]-4-(3,5-difluorophenyl)benzonitrile;2,6-bis[3,6-bis(2-phenyl-4-pyridinyl)carbazol-9-yl]-4-(3,5-difluorophenyl)benzonitrile;4-(3,5-difluorophenyl)-2,6-bis[2-(2-phenyl-3-pyridinyl)carbazol-9-yl]benzonitrile;4-(3,5-difluorophenyl)-2,6-bis[3-(2-phenyl-3-pyridinyl)carbazol-9-yl]benzonitrile
CID 158091253
9-[2-(3,5-difluorophenyl)-4-(2,7-diphenylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-2,7-diphenylcarbazole;9-[2-(3,5-difluorophenyl)-4-(2-phenylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-2-phenylcarbazole;9-[2-(3,5-difluorophenyl)-4-(3-phenylcarbazol-9-yl)-5-(trifluoromethyl)phenyl]-3-phenylcarbazole
CID 158702120

Frequently Asked Questions

What is the IUPAC name of 5-[3-[3-[6-[9-[4-[2,7-bis(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-cyano-2-(3,5-difluorophenyl)phenyl]-7-(6-phenyl-2-pyridinyl)carbazol-2-yl]-2-phenyl-3-pyridinyl]-5-phenylphenyl]carbazol-9-yl]-4-(3,5-difluorophenyl)-2-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]benzonitrile?
The IUPAC name of 5-[3-[3-[6-[9-[4-[2,7-bis(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-cyano-2-(3,5-difluorophenyl)phenyl]-7-(6-phenyl-2-pyridinyl)carbazol-2-yl]-2-phenyl-3-pyridinyl]-5-phenylphenyl]carbazol-9-yl]-4-(3,5-difluorophenyl)-2-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]benzonitrile (CID 154959912) is 5-[3-[3-[6-[9-[4-[2,7-bis(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-cyano-2-(3,5-difluorophenyl)phenyl]-7-(6-phenyl-2-pyridinyl)carbazol-2-yl]-2-phenyl-3-pyridinyl]-5-phenylphenyl]carbazol-9-yl]-4-(3,5-difluorophenyl)-2-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]benzonitrile.
What is the SMILES notation for 5-[3-[3-[6-[9-[4-[2,7-bis(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-cyano-2-(3,5-difluorophenyl)phenyl]-7-(6-phenyl-2-pyridinyl)carbazol-2-yl]-2-phenyl-3-pyridinyl]-5-phenylphenyl]carbazol-9-yl]-4-(3,5-difluorophenyl)-2-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]benzonitrile?
The canonical SMILES for 5-[3-[3-[6-[9-[4-[2,7-bis(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-cyano-2-(3,5-difluorophenyl)phenyl]-7-(6-phenyl-2-pyridinyl)carbazol-2-yl]-2-phenyl-3-pyridinyl]-5-phenylphenyl]carbazol-9-yl]-4-(3,5-difluorophenyl)-2-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]benzonitrile is N#Cc1cc(-n2c3ccccc3c3cc(-c4cc(-c5ccccc5)cc(-c5ccc(-c6ccc7c8ccc(-c9cccc(-c%10ccccc%10)n9)cc8n(-c8cc(C#N)c(-n9c%10cc(-c%11cccc(-c%12ccccc%12)n%11)ccc%10c%10ccc(-c%11cccc(-c%12ccccc%12)n%11)cc%109)cc8-c8cc(F)cc(F)c8)c7c6)nc5-c5ccccc5)c4)ccc32)c(-c2cc(F)cc(F)c2)cc1-n1c2ccccc2c2cc(-c3cccc(-c4ccccc4)n3)ccc21.
What is the InChIKey of 5-[3-[3-[6-[9-[4-[2,7-bis(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-cyano-2-(3,5-difluorophenyl)phenyl]-7-(6-phenyl-2-pyridinyl)carbazol-2-yl]-2-phenyl-3-pyridinyl]-5-phenylphenyl]carbazol-9-yl]-4-(3,5-difluorophenyl)-2-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]benzonitrile?
The InChIKey is SJVIZUUINGZIFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C141H83F4N11/c142-105-68-101(69-106(143)80-105)116-82-133(153-129-49-21-19-40-111(129)119-73-93(56-64-131(119)153)124-45-23-41-120(148-124)87-29-9-2-10-30-87)103(84-146)78-139(116)154-130-50-22-20-39-110(130)118-72-92(55-63-132(118)154)99-65-98(86-27-7-1-8-28-86)66-100(67-99)109-61-62-128(152-141(109)91-37-17-6-18-38-91)97-54-60-115-114-59-53-96(127-48-26-44-123(151-127)90-35-15-5-16-36-90)76-137(114)156(138(115)77-97)140-79-104(85-147)134(83-117(140)102-70-107(144)81-108(145)71-102)155-135-74-94(125-46-24-42-121(149-125)88-31-11-3-12-32-88)51-57-112(135)113-58-52-95(75-136(113)155)126-47-25-43-122(150-126)89-33-13-4-14-34-89/h1-83H.
What are the key properties of 5-[3-[3-[6-[9-[4-[2,7-bis(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-cyano-2-(3,5-difluorophenyl)phenyl]-7-(6-phenyl-2-pyridinyl)carbazol-2-yl]-2-phenyl-3-pyridinyl]-5-phenylphenyl]carbazol-9-yl]-4-(3,5-difluorophenyl)-2-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]benzonitrile?
5-[3-[3-[6-[9-[4-[2,7-bis(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-cyano-2-(3,5-difluorophenyl)phenyl]-7-(6-phenyl-2-pyridinyl)carbazol-2-yl]-2-phenyl-3-pyridinyl]-5-phenylphenyl]carbazol-9-yl]-4-(3,5-difluorophenyl)-2-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]benzonitrile has a molecular weight of 2007.28 g/mol, XLogP of 36.35, 19 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-[3-[6-[9-[4-[2,7-bis(6-phenyl-2-pyridinyl)carbazol-9-yl]-5-cyano-2-(3,5-difluorophenyl)phenyl]-7-(6-phenyl-2-pyridinyl)carbazol-2-yl]-2-phenyl-3-pyridinyl]-5-phenylphenyl]carbazol-9-yl]-4-(3,5-difluorophenyl)-2-[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]benzonitrile is sourced from PubChem (CID 154959912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).