N-(4-carbazol-9-ylphenyl)-N-[4-[3-[4-[4-[4-[9-[4-[4-[3-[4-(4-carbazol-9-yl-N-quinolin-5-ylanilino)phenyl]quinoxalin-2-yl]-N-quinolin-5-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]-N-isoquinolin-4-ylanilino]phenyl]quinoxalin-2-yl]phenyl]isoquinolin-4-amine

C148H94N16 — CID 161371853

IUPACN-(4-carbazol-9-ylphenyl)-N-[4-[3-[4-[4-[4-[9-[4-[4-[3-[4-(4-carbazol-9-yl-N-quinolin-5-ylanilino)phenyl]quinoxalin-2-yl]-N-quinolin-5-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]-N-isoquinolin-4-ylanilino]phenyl]quinoxalin-2-yl]phenyl]isoquinolin-4-amine
SMILESc1ccc2c(N(c3ccc(-c4nc5ccccc5nc4-c4ccc(N(c5ccc(-n6c7ccccc7c7c(-c8cccc9c8c8ccccc8n9-c8ccc(N(c9ccc(-c%10nc%11ccccc%11nc%10-c%10ccc(N(c%11ccc(-n%12c%13ccccc%13c%13ccccc%13%12)cc%11)c%11cccc%12ncccc%11%12)cc%10)cc9)c9cccc%10ncccc9%10)cc8)cccc76)cc5)c5cncc6ccccc56)cc4)cc3)c3ccc(-n4c5ccccc5c5ccccc54)cc3)cncc2c1
InChIInChI=1S/C148H94N16/c1-3-29-113-99(27-1)91-149-93-141(113)159(107-77-83-110(84-78-107)162-133-49-17-7-33-117(133)118-34-8-18-50-134(118)162)103-69-61-97(62-70-103)147-148(156-130-44-14-13-43-129(130)155-147)98-63-71-104(72-64-98)160(142-94-150-92-100-28-2-4-30-114(100)142)108-79-87-112(88-80-108)164-138-52-20-10-36-124(138)144-120(38-22-56-140(144)164)119-37-21-55-139-143(119)123-35-9-19-51-137(123)163(139)111-85-75-106(76-86-111)158(136-54-24-46-126-122(136)40-26-90-152-126)102-67-59-96(60-68-102)146-145(153-127-41-11-12-42-128(127)154-146)95-57-65-101(66-58-95)157(135-53-23-45-125-121(135)39-25-89-151-125)105-73-81-109(82-74-105)161-131-47-15-5-31-115(131)116-32-6-16-48-132(116)161/h1-94H
InChIKeyVQOHGMMGMCQBDO-UHFFFAOYSA-N
MW2096.49 g/mol
LogP38.37
Rot. Bonds21

About N-(4-carbazol-9-ylphenyl)-N-[4-[3-[4-[4-[4-[9-[4-[4-[3-[4-(4-carbazol-9-yl-N-quinolin-5-ylanilino)phenyl]quinoxalin-2-yl]-N-quinolin-5-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]-N-isoquinolin-4-ylanilino]phenyl]quinoxalin-2-yl]phenyl]isoquinolin-4-amine

N-(4-carbazol-9-ylphenyl)-N-[4-[3-[4-[4-[4-[9-[4-[4-[3-[4-(4-carbazol-9-yl-N-quinolin-5-ylanilino)phenyl]quinoxalin-2-yl]-N-quinolin-5-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]-N-isoquinolin-4-ylanilino]phenyl]quinoxalin-2-yl]phenyl]isoquinolin-4-amine (PubChem CID 161371853) has the molecular formula C148H94N16 and a molecular weight of 2096.49 g/mol. Its IUPAC name is N-(4-carbazol-9-ylphenyl)-N-[4-[3-[4-[4-[4-[9-[4-[4-[3-[4-(4-carbazol-9-yl-N-quinolin-5-ylanilino)phenyl]quinoxalin-2-yl]-N-quinolin-5-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]-N-isoquinolin-4-ylanilino]phenyl]quinoxalin-2-yl]phenyl]isoquinolin-4-amine.

Molecular Properties

Compound NameN-(4-carbazol-9-ylphenyl)-N-[4-[3-[4-[4-[4-[9-[4-[4-[3-[4-(4-carbazol-9-yl-N-quinolin-5-ylanilino)phenyl]quinoxalin-2-yl]-N-quinolin-5-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]-N-isoquinolin-4-ylanilino]phenyl]quinoxalin-2-yl]phenyl]isoquinolin-4-amine
PubChem CID161371853
Molecular FormulaC148H94N16
Molecular Weight2096.49 g/mol
Exact Mass2094.78
IUPAC NameN-(4-carbazol-9-ylphenyl)-N-[4-[3-[4-[4-[4-[9-[4-[4-[3-[4-(4-carbazol-9-yl-N-quinolin-5-ylanilino)phenyl]quinoxalin-2-yl]-N-quinolin-5-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]-N-isoquinolin-4-ylanilino]phenyl]quinoxalin-2-yl]phenyl]isoquinolin-4-amine
SMILESc1ccc2c(N(c3ccc(-c4nc5ccccc5nc4-c4ccc(N(c5ccc(-n6c7ccccc7c7c(-c8cccc9c8c8ccccc8n9-c8ccc(N(c9ccc(-c%10nc%11ccccc%11nc%10-c%10ccc(N(c%11ccc(-n%12c%13ccccc%13c%13ccccc%13%12)cc%11)c%11cccc%12ncccc%11%12)cc%10)cc9)c9cccc%10ncccc9%10)cc8)cccc76)cc5)c5cncc6ccccc56)cc4)cc3)c3ccc(-n4c5ccccc5c5ccccc54)cc3)cncc2c1
InChIInChI=1S/C148H94N16/c1-3-29-113-99(27-1)91-149-93-141(113)159(107-77-83-110(84-78-107)162-133-49-17-7-33-117(133)118-34-8-18-50-134(118)162)103-69-61-97(62-70-103)147-148(156-130-44-14-13-43-129(130)155-147)98-63-71-104(72-64-98)160(142-94-150-92-100-28-2-4-30-114(100)142)108-79-87-112(88-80-108)164-138-52-20-10-36-124(138)144-120(38-22-56-140(144)164)119-37-21-55-139-143(119)123-35-9-19-51-137(123)163(139)111-85-75-106(76-86-111)158(136-54-24-46-126-122(136)40-26-90-152-126)102-67-59-96(60-68-102)146-145(153-127-41-11-12-42-128(127)154-146)95-57-65-101(66-58-95)157(135-53-23-45-125-121(135)39-25-89-151-125)105-73-81-109(82-74-105)161-131-47-15-5-31-115(131)116-32-6-16-48-132(116)161/h1-94H
InChIKeyVQOHGMMGMCQBDO-UHFFFAOYSA-N
XLogP38.37
TPSA135.80 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds21
Heavy Atoms164
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002096.49
LogP ≤ 538.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze N-(4-carbazol-9-ylphenyl)-N-[4-[3-[4-[4-[4-[9-[4-[4-[3-[4-(4-carbazol-9-yl-N-quinolin-5-ylanilino)phenyl]quinoxalin-2-yl]-N-quinolin-5-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]-N-isoquinolin-4-ylanilino]phenyl]quinoxalin-2-yl]phenyl]isoquinolin-4-amine with MolForge

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Related Compounds

N-[4-(3,6-dinaphthalen-1-ylcarbazol-9-yl)phenyl]-N-[4-(3-phenylquinoxalin-2-yl)phenyl]quinolin-8-amine
CID 59501091
N-(4-carbazol-9-ylphenyl)-N-phenyl-4-(3-phenylquinoxalin-2-yl)naphthalen-1-amine
CID 59260010
N-(4-carbazol-9-ylphenyl)-6-phenyl-N-[4-(3-phenylquinoxalin-2-yl)phenyl]pyridin-3-amine
CID 59501105
N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)naphthalen-1-yl]quinoxalin-2-yl]-N-phenylnaphthalen-1-amine;N-(4-carbazol-9-ylphenyl)-5-[3-[5-(N-(4-carbazol-9-ylphenyl)anilino)naphthalen-1-yl]quinoxalin-2-yl]-N-phenylnaphthalen-1-amine;N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)phenyl]-5,8-bis(4-phenylphenyl)quinoxalin-2-yl]-N-phenylaniline;N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)phenyl]-5,8-diphenylquinoxalin-2-yl]-N-phenylaniline
CID 158264499
N-(4-carbazol-9-ylphenyl)-N-[4-(3-phenylquinoxalin-2-yl)phenyl]isoquinolin-7-amine
CID 59501052
N,9-diphenyl-N-[4-[3-[4-(N-(9-phenylcarbazol-3-yl)anilino)naphthalen-1-yl]quinoxalin-2-yl]naphthalen-1-yl]carbazol-3-amine;N,9-diphenyl-N-[5-[3-[5-(N-(9-phenylcarbazol-3-yl)anilino)naphthalen-1-yl]quinoxalin-2-yl]naphthalen-1-yl]carbazol-3-amine;N,9-diphenyl-N-[4-[4-[3-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]quinoxalin-2-yl]phenyl]phenyl]carbazol-3-amine
CID 158704413
N,N-bis(4-phenylphenyl)-2-[3-[9-(4-phenylphenyl)carbazol-4-yl]phenyl]aniline
CID 167196113
N-(4-phenylphenyl)-N-[4-[2-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]phenyl]naphthalen-1-amine
CID 126627984
N-[3-(9-phenylcarbazol-4-yl)phenyl]-N-[4-(3-phenylphenyl)phenyl]naphthalen-1-amine
CID 166659485
N-[4-[3-[4-(4-carbazol-9-yl-N-[6-(4-methylphenyl)-3-pyridinyl]anilino)phenyl]quinoxalin-2-yl]phenyl]-N-(4-carbazol-9-ylphenyl)-6-(4-methylphenyl)pyridin-3-amine;N-[4-(3,6-diethylcarbazol-9-yl)phenyl]-N-[4-[3-[4-[4-(3,6-diethylcarbazol-9-yl)-N-quinolin-8-ylanilino]phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine;N-[4-(3,6-dimethylcarbazol-9-yl)phenyl]-N-[4-[3-[4-[4-(3,6-dimethylcarbazol-9-yl)-N-quinolin-8-ylanilino]phenyl]quinoxalin-2-yl]phenyl]quinolin-8-amine
CID 158376941
N-phenyl-N-[4-[4-[1-(2-phenylphenyl)benzo[c]carbazol-7-yl]phenyl]phenyl]naphthalen-1-amine
CID 177101002
N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[3-(9-phenylcarbazol-4-yl)phenyl]naphthalen-1-amine
CID 167195242

Frequently Asked Questions

What is the IUPAC name of N-(4-carbazol-9-ylphenyl)-N-[4-[3-[4-[4-[4-[9-[4-[4-[3-[4-(4-carbazol-9-yl-N-quinolin-5-ylanilino)phenyl]quinoxalin-2-yl]-N-quinolin-5-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]-N-isoquinolin-4-ylanilino]phenyl]quinoxalin-2-yl]phenyl]isoquinolin-4-amine?
The IUPAC name of N-(4-carbazol-9-ylphenyl)-N-[4-[3-[4-[4-[4-[9-[4-[4-[3-[4-(4-carbazol-9-yl-N-quinolin-5-ylanilino)phenyl]quinoxalin-2-yl]-N-quinolin-5-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]-N-isoquinolin-4-ylanilino]phenyl]quinoxalin-2-yl]phenyl]isoquinolin-4-amine (CID 161371853) is N-(4-carbazol-9-ylphenyl)-N-[4-[3-[4-[4-[4-[9-[4-[4-[3-[4-(4-carbazol-9-yl-N-quinolin-5-ylanilino)phenyl]quinoxalin-2-yl]-N-quinolin-5-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]-N-isoquinolin-4-ylanilino]phenyl]quinoxalin-2-yl]phenyl]isoquinolin-4-amine.
What is the SMILES notation for N-(4-carbazol-9-ylphenyl)-N-[4-[3-[4-[4-[4-[9-[4-[4-[3-[4-(4-carbazol-9-yl-N-quinolin-5-ylanilino)phenyl]quinoxalin-2-yl]-N-quinolin-5-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]-N-isoquinolin-4-ylanilino]phenyl]quinoxalin-2-yl]phenyl]isoquinolin-4-amine?
The canonical SMILES for N-(4-carbazol-9-ylphenyl)-N-[4-[3-[4-[4-[4-[9-[4-[4-[3-[4-(4-carbazol-9-yl-N-quinolin-5-ylanilino)phenyl]quinoxalin-2-yl]-N-quinolin-5-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]-N-isoquinolin-4-ylanilino]phenyl]quinoxalin-2-yl]phenyl]isoquinolin-4-amine is c1ccc2c(N(c3ccc(-c4nc5ccccc5nc4-c4ccc(N(c5ccc(-n6c7ccccc7c7c(-c8cccc9c8c8ccccc8n9-c8ccc(N(c9ccc(-c%10nc%11ccccc%11nc%10-c%10ccc(N(c%11ccc(-n%12c%13ccccc%13c%13ccccc%13%12)cc%11)c%11cccc%12ncccc%11%12)cc%10)cc9)c9cccc%10ncccc9%10)cc8)cccc76)cc5)c5cncc6ccccc56)cc4)cc3)c3ccc(-n4c5ccccc5c5ccccc54)cc3)cncc2c1.
What is the InChIKey of N-(4-carbazol-9-ylphenyl)-N-[4-[3-[4-[4-[4-[9-[4-[4-[3-[4-(4-carbazol-9-yl-N-quinolin-5-ylanilino)phenyl]quinoxalin-2-yl]-N-quinolin-5-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]-N-isoquinolin-4-ylanilino]phenyl]quinoxalin-2-yl]phenyl]isoquinolin-4-amine?
The InChIKey is VQOHGMMGMCQBDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C148H94N16/c1-3-29-113-99(27-1)91-149-93-141(113)159(107-77-83-110(84-78-107)162-133-49-17-7-33-117(133)118-34-8-18-50-134(118)162)103-69-61-97(62-70-103)147-148(156-130-44-14-13-43-129(130)155-147)98-63-71-104(72-64-98)160(142-94-150-92-100-28-2-4-30-114(100)142)108-79-87-112(88-80-108)164-138-52-20-10-36-124(138)144-120(38-22-56-140(144)164)119-37-21-55-139-143(119)123-35-9-19-51-137(123)163(139)111-85-75-106(76-86-111)158(136-54-24-46-126-122(136)40-26-90-152-126)102-67-59-96(60-68-102)146-145(153-127-41-11-12-42-128(127)154-146)95-57-65-101(66-58-95)157(135-53-23-45-125-121(135)39-25-89-151-125)105-73-81-109(82-74-105)161-131-47-15-5-31-115(131)116-32-6-16-48-132(116)161/h1-94H.
What are the key properties of N-(4-carbazol-9-ylphenyl)-N-[4-[3-[4-[4-[4-[9-[4-[4-[3-[4-(4-carbazol-9-yl-N-quinolin-5-ylanilino)phenyl]quinoxalin-2-yl]-N-quinolin-5-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]-N-isoquinolin-4-ylanilino]phenyl]quinoxalin-2-yl]phenyl]isoquinolin-4-amine?
N-(4-carbazol-9-ylphenyl)-N-[4-[3-[4-[4-[4-[9-[4-[4-[3-[4-(4-carbazol-9-yl-N-quinolin-5-ylanilino)phenyl]quinoxalin-2-yl]-N-quinolin-5-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]-N-isoquinolin-4-ylanilino]phenyl]quinoxalin-2-yl]phenyl]isoquinolin-4-amine has a molecular weight of 2096.49 g/mol, XLogP of 38.37, 21 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-carbazol-9-ylphenyl)-N-[4-[3-[4-[4-[4-[9-[4-[4-[3-[4-(4-carbazol-9-yl-N-quinolin-5-ylanilino)phenyl]quinoxalin-2-yl]-N-quinolin-5-ylanilino]phenyl]carbazol-4-yl]carbazol-9-yl]-N-isoquinolin-4-ylanilino]phenyl]quinoxalin-2-yl]phenyl]isoquinolin-4-amine is sourced from PubChem (CID 161371853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).