9-[3-carbazol-9-yl-5-(7-carbazol-9-yltriphenylen-2-yl)phenyl]carbazole

C60H37N3 — CID 88884836

IUPAC9-[3-carbazol-9-yl-5-(7-carbazol-9-yltriphenylen-2-yl)phenyl]carbazole
SMILESc1ccc2c(c1)c1cc(-c3cc(-n4c5ccccc5c5ccccc54)cc(-n4c5ccccc5c5ccccc54)c3)ccc1c1ccc(-n3c4ccccc4c4ccccc43)cc21
InChIInChI=1S/C60H37N3/c1-2-16-44-43(15-1)53-35-38(29-31-45(53)46-32-30-40(37-54(44)46)61-55-23-9-3-17-47(55)48-18-4-10-24-56(48)61)39-33-41(62-57-25-11-5-19-49(57)50-20-6-12-26-58(50)62)36-42(34-39)63-59-27-13-7-21-51(59)52-22-8-14-28-60(52)63/h1-37H
InChIKeyRGCMCGQEZDQZCL-UHFFFAOYSA-N
MW799.98 g/mol
LogP16.10
Rot. Bonds4

About 9-[3-carbazol-9-yl-5-(7-carbazol-9-yltriphenylen-2-yl)phenyl]carbazole

9-[3-carbazol-9-yl-5-(7-carbazol-9-yltriphenylen-2-yl)phenyl]carbazole (PubChem CID 88884836) has the molecular formula C60H37N3 and a molecular weight of 799.98 g/mol. Its IUPAC name is 9-[3-carbazol-9-yl-5-(7-carbazol-9-yltriphenylen-2-yl)phenyl]carbazole.

Molecular Properties

Compound Name9-[3-carbazol-9-yl-5-(7-carbazol-9-yltriphenylen-2-yl)phenyl]carbazole
PubChem CID88884836
Molecular FormulaC60H37N3
Molecular Weight799.98 g/mol
Exact Mass799.30
IUPAC Name9-[3-carbazol-9-yl-5-(7-carbazol-9-yltriphenylen-2-yl)phenyl]carbazole
SMILESc1ccc2c(c1)c1cc(-c3cc(-n4c5ccccc5c5ccccc54)cc(-n4c5ccccc5c5ccccc54)c3)ccc1c1ccc(-n3c4ccccc4c4ccccc43)cc21
InChIInChI=1S/C60H37N3/c1-2-16-44-43(15-1)53-35-38(29-31-45(53)46-32-30-40(37-54(44)46)61-55-23-9-3-17-47(55)48-18-4-10-24-56(48)61)39-33-41(62-57-25-11-5-19-49(57)50-20-6-12-26-58(50)62)36-42(34-39)63-59-27-13-7-21-51(59)52-22-8-14-28-60(52)63/h1-37H
InChIKeyRGCMCGQEZDQZCL-UHFFFAOYSA-N
XLogP16.10
TPSA14.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms63
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500799.98
LogP ≤ 516.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[9-(3,5-diphenylphenyl)carbazol-2-yl]-9-triphenylen-2-ylcarbazole
CID 142356273
9-(3-triphenylen-2-ylphenyl)carbazole
CID 88924379
3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-[3-(4-phenylphenyl)phenyl]carbazole;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole
CID 164968359
9-[6,10-di(carbazol-9-yl)triphenylen-2-yl]carbazole
CID 122548627
9-[3-(7-phenyltriphenylen-2-yl)phenyl]carbazole
CID 174278174
9-[3-[3,5-bis[3,5-di(carbazol-9-yl)phenyl]phenyl]-5-carbazol-9-ylphenyl]carbazole
CID 102341656
3-carbazol-9-yl-9-[3-phenyl-5-[3-[9-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-3-yl]phenyl]phenyl]carbazole
CID 138601418
9-[3-carbazol-9-yl-5-[3,5-di(carbazol-9-yl)phenyl]phenyl]carbazole;3-carbazol-9-yl-9-phenylcarbazole
CID 163609508
7-[3,5-di(carbazol-9-yl)phenyl]-N,N-diphenyltriphenylen-2-amine
CID 88884831
5,11-di(triphenylen-2-yl)indolo[3,2-b]carbazole
CID 166009559
3-[9-[9-(3-carbazol-9-ylphenyl)carbazol-3-yl]carbazol-3-yl]-9-phenylcarbazole
CID 170315703
9-phenyl-3-[4-(3-triphenylen-2-ylcarbazol-9-yl)phenyl]carbazole
CID 126682035

Frequently Asked Questions

What is the IUPAC name of 9-[3-carbazol-9-yl-5-(7-carbazol-9-yltriphenylen-2-yl)phenyl]carbazole?
The IUPAC name of 9-[3-carbazol-9-yl-5-(7-carbazol-9-yltriphenylen-2-yl)phenyl]carbazole (CID 88884836) is 9-[3-carbazol-9-yl-5-(7-carbazol-9-yltriphenylen-2-yl)phenyl]carbazole.
What is the SMILES notation for 9-[3-carbazol-9-yl-5-(7-carbazol-9-yltriphenylen-2-yl)phenyl]carbazole?
The canonical SMILES for 9-[3-carbazol-9-yl-5-(7-carbazol-9-yltriphenylen-2-yl)phenyl]carbazole is c1ccc2c(c1)c1cc(-c3cc(-n4c5ccccc5c5ccccc54)cc(-n4c5ccccc5c5ccccc54)c3)ccc1c1ccc(-n3c4ccccc4c4ccccc43)cc21.
What is the InChIKey of 9-[3-carbazol-9-yl-5-(7-carbazol-9-yltriphenylen-2-yl)phenyl]carbazole?
The InChIKey is RGCMCGQEZDQZCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H37N3/c1-2-16-44-43(15-1)53-35-38(29-31-45(53)46-32-30-40(37-54(44)46)61-55-23-9-3-17-47(55)48-18-4-10-24-56(48)61)39-33-41(62-57-25-11-5-19-49(57)50-20-6-12-26-58(50)62)36-42(34-39)63-59-27-13-7-21-51(59)52-22-8-14-28-60(52)63/h1-37H.
What are the key properties of 9-[3-carbazol-9-yl-5-(7-carbazol-9-yltriphenylen-2-yl)phenyl]carbazole?
9-[3-carbazol-9-yl-5-(7-carbazol-9-yltriphenylen-2-yl)phenyl]carbazole has a molecular weight of 799.98 g/mol, XLogP of 16.10, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-carbazol-9-yl-5-(7-carbazol-9-yltriphenylen-2-yl)phenyl]carbazole is sourced from PubChem (CID 88884836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).