4-[3-[10-(4-carbazol-9-ylphenyl)anthracen-9-yl]quinolin-7-yl]-9-[4-[10-[8-[9-[4-(10-imidazo[1,2-a]pyridin-2-ylanthracen-9-yl)phenyl]carbazol-4-yl]quinolin-3-yl]anthracen-9-yl]phenyl]carbazole

C121H73N7 — CID 147322471

IUPAC4-[3-[10-(4-carbazol-9-ylphenyl)anthracen-9-yl]quinolin-7-yl]-9-[4-[10-[8-[9-[4-(10-imidazo[1,2-a]pyridin-2-ylanthracen-9-yl)phenyl]carbazol-4-yl]quinolin-3-yl]anthracen-9-yl]phenyl]carbazole
SMILESc1cc(-c2cccc3c2c2ccccc2n3-c2ccc(-c3c4ccccc4c(-c4cn5ccccc5n4)c4ccccc34)cc2)c2ncc(-c3c4ccccc4c(-c4ccc(-n5c6ccccc6c6c(-c7ccc8cc(-c9c%10ccccc%10c(-c%10ccc(-n%11c%12ccccc%12c%12ccccc%12%11)cc%10)c%10ccccc9%10)cnc8c7)cccc65)cc4)c4ccccc34)cc2c1
InChIInChI=1S/C121H73N7/c1-5-33-92-88(29-1)113(74-55-61-82(62-56-74)126-106-46-17-13-27-86(106)87-28-14-18-47-107(87)126)89-30-2-6-34-93(89)116(92)80-68-78-54-53-77(70-104(78)122-71-80)85-43-24-50-110-119(85)102-41-15-19-48-108(102)127(110)83-63-57-75(58-64-83)114-90-31-3-7-35-94(90)117(95-36-8-4-32-91(95)114)81-69-79-26-23-45-101(121(79)123-72-81)100-44-25-51-111-120(100)103-42-16-20-49-109(103)128(111)84-65-59-76(60-66-84)115-96-37-9-11-39-98(96)118(99-40-12-10-38-97(99)115)105-73-125-67-22-21-52-112(125)124-105/h1-73H
InChIKeyDABJJLFDFNJLBI-UHFFFAOYSA-N
MW1624.96 g/mol
LogP31.98
Rot. Bonds11

About 4-[3-[10-(4-carbazol-9-ylphenyl)anthracen-9-yl]quinolin-7-yl]-9-[4-[10-[8-[9-[4-(10-imidazo[1,2-a]pyridin-2-ylanthracen-9-yl)phenyl]carbazol-4-yl]quinolin-3-yl]anthracen-9-yl]phenyl]carbazole

4-[3-[10-(4-carbazol-9-ylphenyl)anthracen-9-yl]quinolin-7-yl]-9-[4-[10-[8-[9-[4-(10-imidazo[1,2-a]pyridin-2-ylanthracen-9-yl)phenyl]carbazol-4-yl]quinolin-3-yl]anthracen-9-yl]phenyl]carbazole (PubChem CID 147322471) has the molecular formula C121H73N7 and a molecular weight of 1624.96 g/mol. Its IUPAC name is 4-[3-[10-(4-carbazol-9-ylphenyl)anthracen-9-yl]quinolin-7-yl]-9-[4-[10-[8-[9-[4-(10-imidazo[1,2-a]pyridin-2-ylanthracen-9-yl)phenyl]carbazol-4-yl]quinolin-3-yl]anthracen-9-yl]phenyl]carbazole.

Molecular Properties

Compound Name4-[3-[10-(4-carbazol-9-ylphenyl)anthracen-9-yl]quinolin-7-yl]-9-[4-[10-[8-[9-[4-(10-imidazo[1,2-a]pyridin-2-ylanthracen-9-yl)phenyl]carbazol-4-yl]quinolin-3-yl]anthracen-9-yl]phenyl]carbazole
PubChem CID147322471
Molecular FormulaC121H73N7
Molecular Weight1624.96 g/mol
Exact Mass1623.59
IUPAC Name4-[3-[10-(4-carbazol-9-ylphenyl)anthracen-9-yl]quinolin-7-yl]-9-[4-[10-[8-[9-[4-(10-imidazo[1,2-a]pyridin-2-ylanthracen-9-yl)phenyl]carbazol-4-yl]quinolin-3-yl]anthracen-9-yl]phenyl]carbazole
SMILESc1cc(-c2cccc3c2c2ccccc2n3-c2ccc(-c3c4ccccc4c(-c4cn5ccccc5n4)c4ccccc34)cc2)c2ncc(-c3c4ccccc4c(-c4ccc(-n5c6ccccc6c6c(-c7ccc8cc(-c9c%10ccccc%10c(-c%10ccc(-n%11c%12ccccc%12c%12ccccc%12%11)cc%10)c%10ccccc9%10)cnc8c7)cccc65)cc4)c4ccccc34)cc2c1
InChIInChI=1S/C121H73N7/c1-5-33-92-88(29-1)113(74-55-61-82(62-56-74)126-106-46-17-13-27-86(106)87-28-14-18-47-107(87)126)89-30-2-6-34-93(89)116(92)80-68-78-54-53-77(70-104(78)122-71-80)85-43-24-50-110-119(85)102-41-15-19-48-108(102)127(110)83-63-57-75(58-64-83)114-90-31-3-7-35-94(90)117(95-36-8-4-32-91(95)114)81-69-79-26-23-45-101(121(79)123-72-81)100-44-25-51-111-120(100)103-42-16-20-49-109(103)128(111)84-65-59-76(60-66-84)115-96-37-9-11-39-98(96)118(99-40-12-10-38-97(99)115)105-73-125-67-22-21-52-112(125)124-105/h1-73H
InChIKeyDABJJLFDFNJLBI-UHFFFAOYSA-N
XLogP31.98
TPSA57.87 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds11
Heavy Atoms128
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001624.96
LogP ≤ 531.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 4-[3-[10-(4-carbazol-9-ylphenyl)anthracen-9-yl]quinolin-7-yl]-9-[4-[10-[8-[9-[4-(10-imidazo[1,2-a]pyridin-2-ylanthracen-9-yl)phenyl]carbazol-4-yl]quinolin-3-yl]anthracen-9-yl]phenyl]carbazole with MolForge

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Related Compounds

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Dibenzo(f,h)pyrido(2,3-b)quinoxaline
CID 258692
1-[[3-[(4-Cyanophenyl)methyl]imidazol-4-yl]methyl]-5-naphthalen-1-ylindole-6-carbonitrile
CID 44445095
6-Imidazo[1,2-a]pyridin-2-yl-4-methyl-2-propyl-1-[2''-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-1H-benzoimidazole
CID 10052528
6-((4-(2-(4-Tert-butylphenyl)imidazo[1,2-a]pyridin-8-yl)piperazin-1-yl)methyl)quinoxaline
CID 15602807
4-[7-[4-(4-Methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]quinoline
CID 54765389
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CID 71666520
6-[4-(4-methylpiperazin-1-yl)phenyl]-4-(4-naphthalen-1-ylphenyl)-9H-pyrido[2,3-b]indole
CID 72194921
8-Fluoro-6-[1-(5-quinolin-3-ylimidazo[4,5-b]pyrazin-3-yl)ethyl]quinoline
CID 86566407
5,7-Difluoro-6-[1-(5-quinolin-3-ylimidazo[4,5-b]pyrazin-3-yl)ethyl]quinoline
CID 86566542
5,7-Difluoro-6-[1-(5-naphthalen-1-ylimidazo[4,5-b]pyrazin-3-yl)ethyl]quinoline
CID 86566598

Frequently Asked Questions

What is the IUPAC name of 4-[3-[10-(4-carbazol-9-ylphenyl)anthracen-9-yl]quinolin-7-yl]-9-[4-[10-[8-[9-[4-(10-imidazo[1,2-a]pyridin-2-ylanthracen-9-yl)phenyl]carbazol-4-yl]quinolin-3-yl]anthracen-9-yl]phenyl]carbazole?
The IUPAC name of 4-[3-[10-(4-carbazol-9-ylphenyl)anthracen-9-yl]quinolin-7-yl]-9-[4-[10-[8-[9-[4-(10-imidazo[1,2-a]pyridin-2-ylanthracen-9-yl)phenyl]carbazol-4-yl]quinolin-3-yl]anthracen-9-yl]phenyl]carbazole (CID 147322471) is 4-[3-[10-(4-carbazol-9-ylphenyl)anthracen-9-yl]quinolin-7-yl]-9-[4-[10-[8-[9-[4-(10-imidazo[1,2-a]pyridin-2-ylanthracen-9-yl)phenyl]carbazol-4-yl]quinolin-3-yl]anthracen-9-yl]phenyl]carbazole.
What is the SMILES notation for 4-[3-[10-(4-carbazol-9-ylphenyl)anthracen-9-yl]quinolin-7-yl]-9-[4-[10-[8-[9-[4-(10-imidazo[1,2-a]pyridin-2-ylanthracen-9-yl)phenyl]carbazol-4-yl]quinolin-3-yl]anthracen-9-yl]phenyl]carbazole?
The canonical SMILES for 4-[3-[10-(4-carbazol-9-ylphenyl)anthracen-9-yl]quinolin-7-yl]-9-[4-[10-[8-[9-[4-(10-imidazo[1,2-a]pyridin-2-ylanthracen-9-yl)phenyl]carbazol-4-yl]quinolin-3-yl]anthracen-9-yl]phenyl]carbazole is c1cc(-c2cccc3c2c2ccccc2n3-c2ccc(-c3c4ccccc4c(-c4cn5ccccc5n4)c4ccccc34)cc2)c2ncc(-c3c4ccccc4c(-c4ccc(-n5c6ccccc6c6c(-c7ccc8cc(-c9c%10ccccc%10c(-c%10ccc(-n%11c%12ccccc%12c%12ccccc%12%11)cc%10)c%10ccccc9%10)cnc8c7)cccc65)cc4)c4ccccc34)cc2c1.
What is the InChIKey of 4-[3-[10-(4-carbazol-9-ylphenyl)anthracen-9-yl]quinolin-7-yl]-9-[4-[10-[8-[9-[4-(10-imidazo[1,2-a]pyridin-2-ylanthracen-9-yl)phenyl]carbazol-4-yl]quinolin-3-yl]anthracen-9-yl]phenyl]carbazole?
The InChIKey is DABJJLFDFNJLBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C121H73N7/c1-5-33-92-88(29-1)113(74-55-61-82(62-56-74)126-106-46-17-13-27-86(106)87-28-14-18-47-107(87)126)89-30-2-6-34-93(89)116(92)80-68-78-54-53-77(70-104(78)122-71-80)85-43-24-50-110-119(85)102-41-15-19-48-108(102)127(110)83-63-57-75(58-64-83)114-90-31-3-7-35-94(90)117(95-36-8-4-32-91(95)114)81-69-79-26-23-45-101(121(79)123-72-81)100-44-25-51-111-120(100)103-42-16-20-49-109(103)128(111)84-65-59-76(60-66-84)115-96-37-9-11-39-98(96)118(99-40-12-10-38-97(99)115)105-73-125-67-22-21-52-112(125)124-105/h1-73H.
What are the key properties of 4-[3-[10-(4-carbazol-9-ylphenyl)anthracen-9-yl]quinolin-7-yl]-9-[4-[10-[8-[9-[4-(10-imidazo[1,2-a]pyridin-2-ylanthracen-9-yl)phenyl]carbazol-4-yl]quinolin-3-yl]anthracen-9-yl]phenyl]carbazole?
4-[3-[10-(4-carbazol-9-ylphenyl)anthracen-9-yl]quinolin-7-yl]-9-[4-[10-[8-[9-[4-(10-imidazo[1,2-a]pyridin-2-ylanthracen-9-yl)phenyl]carbazol-4-yl]quinolin-3-yl]anthracen-9-yl]phenyl]carbazole has a molecular weight of 1624.96 g/mol, XLogP of 31.98, 11 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[10-(4-carbazol-9-ylphenyl)anthracen-9-yl]quinolin-7-yl]-9-[4-[10-[8-[9-[4-(10-imidazo[1,2-a]pyridin-2-ylanthracen-9-yl)phenyl]carbazol-4-yl]quinolin-3-yl]anthracen-9-yl]phenyl]carbazole is sourced from PubChem (CID 147322471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).