3-[9-(2-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole

C54H34N2 — CID 146226350

IUPAC3-[9-(2-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole
SMILESc1ccc(-c2ccccc2-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c6ccccc6c6ccccc6c5c4)ccc32)cc1
InChIInChI=1S/C54H34N2/c1-2-14-35(15-3-1)39-16-8-11-23-50(39)56-52-25-13-10-22-46(52)49-33-37(27-31-54(49)56)36-26-30-53-48(32-36)45-21-9-12-24-51(45)55(53)38-28-29-44-42-19-5-4-17-40(42)41-18-6-7-20-43(41)47(44)34-38/h1-34H
InChIKeyVFNRQACWQWIGHY-UHFFFAOYSA-N
MW710.88 g/mol
LogP14.67
Rot. Bonds4

About 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole

3-[9-(2-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole (PubChem CID 146226350) has the molecular formula C54H34N2 and a molecular weight of 710.88 g/mol. Its IUPAC name is 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole.

Molecular Properties

Compound Name3-[9-(2-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole
PubChem CID146226350
Molecular FormulaC54H34N2
Molecular Weight710.88 g/mol
Exact Mass710.27
IUPAC Name3-[9-(2-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole
SMILESc1ccc(-c2ccccc2-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c6ccccc6c6ccccc6c5c4)ccc32)cc1
InChIInChI=1S/C54H34N2/c1-2-14-35(15-3-1)39-16-8-11-23-50(39)56-52-25-13-10-22-46(52)49-33-37(27-31-54(49)56)36-26-30-53-48(32-36)45-21-9-12-24-51(45)55(53)38-28-29-44-42-19-5-4-17-40(42)41-18-6-7-20-43(41)47(44)34-38/h1-34H
InChIKeyVFNRQACWQWIGHY-UHFFFAOYSA-N
XLogP14.67
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500710.88
LogP ≤ 514.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[3-(4-phenylphenyl)phenyl]carbazole;9-(2-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]carbazole;9-(2-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 160944719
9-(2-phenylphenyl)-3-[9-(2-phenylphenyl)carbazol-3-yl]carbazole;9-(2-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]carbazole;9-(2-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 159485345
3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[4-[4-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590343
3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[2-(4-phenylphenyl)phenyl]carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[4-(3-phenylphenyl)phenyl]carbazole
CID 161451910
9-(2-phenylphenyl)-3-[3-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]carbazole;9-(3-phenylphenyl)-3-[4-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]carbazole
CID 159114299
3-(9-phenylcarbazol-3-yl)-9-[2-[4-(4-phenylphenyl)phenyl]phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[3-[4-(4-phenylphenyl)phenyl]phenyl]carbazole
CID 161093250
3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[3-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590713
3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[4-[4-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]carbazole;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[3-[4-(2-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazole;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 158659415
3-[9-(2-phenylphenyl)carbazol-2-yl]-9-[3-(3-phenylphenyl)phenyl]carbazole
CID 142315053
3-(6,9-diphenylcarbazol-3-yl)-6,9-diphenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-(2-phenylphenyl)carbazole;3-(9-phenylcarbazol-3-yl)-9-[4-(3-phenylphenyl)phenyl]carbazole;9-phenyl-6-(9-phenylcarbazol-3-yl)-2-(3-phenylphenyl)carbazole;9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole;9-[4-(3-phenylphenyl)phenyl]-3-[9-[4-(3-phenylphenyl)phenyl]carbazol-3-yl]carbazole
CID 158933707
3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[3-[4-(2-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[2-[4-[4-[3-[3-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 160721825
3-[9-(2-phenylphenyl)carbazol-3-yl]-9-[3-[4-[3-[3-[4-(2-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590420

Frequently Asked Questions

What is the IUPAC name of 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole?
The IUPAC name of 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole (CID 146226350) is 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole.
What is the SMILES notation for 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole?
The canonical SMILES for 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole is c1ccc(-c2ccccc2-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c6ccccc6c6ccccc6c5c4)ccc32)cc1.
What is the InChIKey of 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole?
The InChIKey is VFNRQACWQWIGHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H34N2/c1-2-14-35(15-3-1)39-16-8-11-23-50(39)56-52-25-13-10-22-46(52)49-33-37(27-31-54(49)56)36-26-30-53-48(32-36)45-21-9-12-24-51(45)55(53)38-28-29-44-42-19-5-4-17-40(42)41-18-6-7-20-43(41)47(44)34-38/h1-34H.
What are the key properties of 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole?
3-[9-(2-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole has a molecular weight of 710.88 g/mol, XLogP of 14.67, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[9-(2-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole is sourced from PubChem (CID 146226350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).