9-[2-(3-dibenzofuran-1-ylphenyl)phenyl]-3,6-diphenylcarbazole

C48H31NO — CID 166037435

IUPAC9-[2-(3-dibenzofuran-1-ylphenyl)phenyl]-3,6-diphenylcarbazole
SMILESc1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccccc2-c2cccc(-c3cccc4oc5ccccc5c34)c2)cc1
InChIInChI=1S/C48H31NO/c1-3-13-32(14-4-1)34-25-27-44-41(30-34)42-31-35(33-15-5-2-6-16-33)26-28-45(42)49(44)43-22-9-7-19-38(43)36-17-11-18-37(29-36)39-21-12-24-47-48(39)40-20-8-10-23-46(40)50-47/h1-31H
InChIKeyXUIKRMLNGXYNDI-UHFFFAOYSA-N
MW637.78 g/mol
LogP13.35
Rot. Bonds5

About 9-[2-(3-dibenzofuran-1-ylphenyl)phenyl]-3,6-diphenylcarbazole

9-[2-(3-dibenzofuran-1-ylphenyl)phenyl]-3,6-diphenylcarbazole (PubChem CID 166037435) has the molecular formula C48H31NO and a molecular weight of 637.78 g/mol. Its IUPAC name is 9-[2-(3-dibenzofuran-1-ylphenyl)phenyl]-3,6-diphenylcarbazole.

Molecular Properties

Compound Name9-[2-(3-dibenzofuran-1-ylphenyl)phenyl]-3,6-diphenylcarbazole
PubChem CID166037435
Molecular FormulaC48H31NO
Molecular Weight637.78 g/mol
Exact Mass637.24
IUPAC Name9-[2-(3-dibenzofuran-1-ylphenyl)phenyl]-3,6-diphenylcarbazole
SMILESc1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccccc2-c2cccc(-c3cccc4oc5ccccc5c34)c2)cc1
InChIInChI=1S/C48H31NO/c1-3-13-32(14-4-1)34-25-27-44-41(30-34)42-31-35(33-15-5-2-6-16-33)26-28-45(42)49(44)43-22-9-7-19-38(43)36-17-11-18-37(29-36)39-21-12-24-47-48(39)40-20-8-10-23-46(40)50-47/h1-31H
InChIKeyXUIKRMLNGXYNDI-UHFFFAOYSA-N
XLogP13.35
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500637.78
LogP ≤ 513.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-[4-(4-dibenzofuran-1-ylphenyl)phenyl]-3-(3-phenylphenyl)carbazole
CID 167329299
3-dibenzofuran-1-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-dibenzofuran-1-yl-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzofuran-1-yl-9-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole
CID 165084980
9-[4-dibenzofuran-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-diphenylcarbazole
CID 155232440
9-(9-dibenzofuran-2-yldibenzofuran-4-yl)-3-phenylcarbazole
CID 153223652
N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-(3-dibenzofuran-1-ylphenyl)-3-phenylaniline
CID 155649338
3-[9-(2-dibenzofuran-1-ylphenyl)carbazol-2-yl]-9-phenylcarbazole
CID 126753266
3-dibenzofuran-1-yl-9-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazole;3-dibenzofuran-1-yl-9-[3-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 165052317
2-[9-(2-phenylphenyl)carbazol-2-yl]-9-[1-(3-phenylphenyl)dibenzofuran-4-yl]carbazole;2-[9-(2-phenylphenyl)carbazol-3-yl]-9-[1-(4-phenylphenyl)dibenzofuran-4-yl]carbazole;2-[9-(2-phenylphenyl)carbazol-4-yl]-9-[1-(4-phenylphenyl)dibenzofuran-4-yl]carbazole
CID 163889924
3-(8-dibenzofuran-1-yldibenzothiophen-2-yl)-6-[3-[6-dibenzothiophen-2-yl-9-(3-phenylphenyl)carbazol-3-yl]phenyl]-9-naphthalen-1-ylcarbazole
CID 138474974
3-dibenzofuran-1-yl-6-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 129292083
9-[4-[4-[4-(3-dibenzofuran-1-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-2-(3-phenylphenyl)phenyl]carbazole
CID 139303441
2-dibenzofuran-1-yl-9-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazole
CID 156521803

Frequently Asked Questions

What is the IUPAC name of 9-[2-(3-dibenzofuran-1-ylphenyl)phenyl]-3,6-diphenylcarbazole?
The IUPAC name of 9-[2-(3-dibenzofuran-1-ylphenyl)phenyl]-3,6-diphenylcarbazole (CID 166037435) is 9-[2-(3-dibenzofuran-1-ylphenyl)phenyl]-3,6-diphenylcarbazole.
What is the SMILES notation for 9-[2-(3-dibenzofuran-1-ylphenyl)phenyl]-3,6-diphenylcarbazole?
The canonical SMILES for 9-[2-(3-dibenzofuran-1-ylphenyl)phenyl]-3,6-diphenylcarbazole is c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccccc2-c2cccc(-c3cccc4oc5ccccc5c34)c2)cc1.
What is the InChIKey of 9-[2-(3-dibenzofuran-1-ylphenyl)phenyl]-3,6-diphenylcarbazole?
The InChIKey is XUIKRMLNGXYNDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H31NO/c1-3-13-32(14-4-1)34-25-27-44-41(30-34)42-31-35(33-15-5-2-6-16-33)26-28-45(42)49(44)43-22-9-7-19-38(43)36-17-11-18-37(29-36)39-21-12-24-47-48(39)40-20-8-10-23-46(40)50-47/h1-31H.
What are the key properties of 9-[2-(3-dibenzofuran-1-ylphenyl)phenyl]-3,6-diphenylcarbazole?
9-[2-(3-dibenzofuran-1-ylphenyl)phenyl]-3,6-diphenylcarbazole has a molecular weight of 637.78 g/mol, XLogP of 13.35, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2-(3-dibenzofuran-1-ylphenyl)phenyl]-3,6-diphenylcarbazole is sourced from PubChem (CID 166037435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).