2-dibenzofuran-4-yl-9-(3-triphenylen-2-ylphenyl)carbazole

C48H29NO — CID 87156606

IUPAC2-dibenzofuran-4-yl-9-(3-triphenylen-2-ylphenyl)carbazole
SMILESc1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)cc(-n2c3ccccc3c3ccc(-c4cccc5c4oc4ccccc45)cc32)c1
InChIInChI=1S/C48H29NO/c1-2-15-37-35(13-1)36-14-3-4-16-38(36)44-28-31(23-25-39(37)44)30-11-9-12-33(27-30)49-45-21-7-5-17-40(45)41-26-24-32(29-46(41)49)34-19-10-20-43-42-18-6-8-22-47(42)50-48(34)43/h1-29H
InChIKeyCAEXFWZXXAWVCO-UHFFFAOYSA-N
MW635.77 g/mol
LogP13.48
Rot. Bonds3

About 2-dibenzofuran-4-yl-9-(3-triphenylen-2-ylphenyl)carbazole

2-dibenzofuran-4-yl-9-(3-triphenylen-2-ylphenyl)carbazole (PubChem CID 87156606) has the molecular formula C48H29NO and a molecular weight of 635.77 g/mol. Its IUPAC name is 2-dibenzofuran-4-yl-9-(3-triphenylen-2-ylphenyl)carbazole.

Molecular Properties

Compound Name2-dibenzofuran-4-yl-9-(3-triphenylen-2-ylphenyl)carbazole
PubChem CID87156606
Molecular FormulaC48H29NO
Molecular Weight635.77 g/mol
Exact Mass635.22
IUPAC Name2-dibenzofuran-4-yl-9-(3-triphenylen-2-ylphenyl)carbazole
SMILESc1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)cc(-n2c3ccccc3c3ccc(-c4cccc5c4oc4ccccc45)cc32)c1
InChIInChI=1S/C48H29NO/c1-2-15-37-35(13-1)36-14-3-4-16-38(36)44-28-31(23-25-39(37)44)30-11-9-12-33(27-30)49-45-21-7-5-17-40(45)41-26-24-32(29-46(41)49)34-19-10-20-43-42-18-6-8-22-47(42)50-48(34)43/h1-29H
InChIKeyCAEXFWZXXAWVCO-UHFFFAOYSA-N
XLogP13.48
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500635.77
LogP ≤ 513.48
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

2-[9-[3-(3-dibenzofuran-4-ylphenyl)phenyl]carbazol-2-yl]-9-phenylcarbazole
CID 166509994
2-[3-dibenzofuran-4-yl-5-(3-phenylphenyl)phenyl]-9-(3-phenylphenyl)carbazole
CID 122492307
3-dibenzofuran-4-yl-9-(3-dibenzofuran-4-ylphenyl)-6-(9-phenylcarbazol-3-yl)carbazole
CID 121449361
2,7-di(dibenzofuran-4-yl)-9-[3-(9,10-diphenylanthracen-2-yl)phenyl]carbazole
CID 87156561
2,7-bis(2,6,8-triphenyldibenzofuran-4-yl)-9-(3-triphenylen-2-ylphenyl)carbazole;2-dibenzofuran-4-yl-9-triphenylen-2-ylcarbazole;2-dibenzofuran-4-yl-9-(3-triphenylen-2-ylphenyl)carbazole;2-(2,8-diphenyldibenzofuran-4-yl)-9-triphenylen-2-ylcarbazole;methane;2-(6-phenyldibenzofuran-4-yl)-9-(3-triphenylen-2-ylphenyl)carbazole
CID 158449114
3-dibenzofuran-4-yl-9-[3-(3-dibenzofuran-4-ylcarbazol-9-yl)phenyl]carbazole
CID 71004884
2-[3-dibenzofuran-4-yl-5-(3-phenylphenyl)phenyl]-9-phenylcarbazole
CID 122492294
9-[3-(8-carbazol-9-yldibenzofuran-4-yl)phenyl]-3-dibenzofuran-4-ylcarbazole
CID 58099745
9-[3-[8-[3-[3-(4-phenylphenyl)phenyl]phenyl]dibenzofuran-4-yl]phenyl]carbazole
CID 118438864
5-(3-dibenzofuran-4-ylphenyl)-7-(4-phenylphenyl)indolo[2,3-b]carbazole
CID 171414718
3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 134313296
11-(4-dibenzofuran-4-ylphenyl)-3,5-diphenylindolo[3,2-b]carbazole
CID 126580169

Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-4-yl-9-(3-triphenylen-2-ylphenyl)carbazole?
The IUPAC name of 2-dibenzofuran-4-yl-9-(3-triphenylen-2-ylphenyl)carbazole (CID 87156606) is 2-dibenzofuran-4-yl-9-(3-triphenylen-2-ylphenyl)carbazole.
What is the SMILES notation for 2-dibenzofuran-4-yl-9-(3-triphenylen-2-ylphenyl)carbazole?
The canonical SMILES for 2-dibenzofuran-4-yl-9-(3-triphenylen-2-ylphenyl)carbazole is c1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)cc(-n2c3ccccc3c3ccc(-c4cccc5c4oc4ccccc45)cc32)c1.
What is the InChIKey of 2-dibenzofuran-4-yl-9-(3-triphenylen-2-ylphenyl)carbazole?
The InChIKey is CAEXFWZXXAWVCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H29NO/c1-2-15-37-35(13-1)36-14-3-4-16-38(36)44-28-31(23-25-39(37)44)30-11-9-12-33(27-30)49-45-21-7-5-17-40(45)41-26-24-32(29-46(41)49)34-19-10-20-43-42-18-6-8-22-47(42)50-48(34)43/h1-29H.
What are the key properties of 2-dibenzofuran-4-yl-9-(3-triphenylen-2-ylphenyl)carbazole?
2-dibenzofuran-4-yl-9-(3-triphenylen-2-ylphenyl)carbazole has a molecular weight of 635.77 g/mol, XLogP of 13.48, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzofuran-4-yl-9-(3-triphenylen-2-ylphenyl)carbazole is sourced from PubChem (CID 87156606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).