2-[3-(4-bromophenyl)phenyl]-9-dibenzofuran-4-ylcarbazole

C36H22BrNO — CID 118505930

IUPAC2-[3-(4-bromophenyl)phenyl]-9-dibenzofuran-4-ylcarbazole
SMILESBrc1ccc(-c2cccc(-c3ccc4c5ccccc5n(-c5cccc6c5oc5ccccc56)c4c3)c2)cc1
InChIInChI=1S/C36H22BrNO/c37-27-18-15-23(16-19-27)24-7-5-8-25(21-24)26-17-20-29-28-9-1-3-12-32(28)38(34(29)22-26)33-13-6-11-31-30-10-2-4-14-35(30)39-36(31)33/h1-22H
InChIKeyRXMYFFGATULXNU-UHFFFAOYSA-N
MW564.48 g/mol
LogP10.78
Rot. Bonds3

About 2-[3-(4-bromophenyl)phenyl]-9-dibenzofuran-4-ylcarbazole

2-[3-(4-bromophenyl)phenyl]-9-dibenzofuran-4-ylcarbazole (PubChem CID 118505930) has the molecular formula C36H22BrNO and a molecular weight of 564.48 g/mol. Its IUPAC name is 2-[3-(4-bromophenyl)phenyl]-9-dibenzofuran-4-ylcarbazole.

Molecular Properties

Compound Name2-[3-(4-bromophenyl)phenyl]-9-dibenzofuran-4-ylcarbazole
PubChem CID118505930
Molecular FormulaC36H22BrNO
Molecular Weight564.48 g/mol
Exact Mass563.09
IUPAC Name2-[3-(4-bromophenyl)phenyl]-9-dibenzofuran-4-ylcarbazole
SMILESBrc1ccc(-c2cccc(-c3ccc4c5ccccc5n(-c5cccc6c5oc5ccccc56)c4c3)c2)cc1
InChIInChI=1S/C36H22BrNO/c37-27-18-15-23(16-19-27)24-7-5-8-25(21-24)26-17-20-29-28-9-1-3-12-32(28)38(34(29)22-26)33-13-6-11-31-30-10-2-4-14-35(30)39-36(31)33/h1-22H
InChIKeyRXMYFFGATULXNU-UHFFFAOYSA-N
XLogP10.78
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500564.48
LogP ≤ 510.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-(9-dibenzofuran-4-ylcarbazol-3-yl)-2,9-diphenylcarbazole
CID 170072505
9-dibenzofuran-4-yl-3-(9-dibenzofuran-4-ylcarbazol-2-yl)-2-phenylcarbazole
CID 90348741
9-(8-dibenzofuran-3-yldibenzofuran-4-yl)-3-phenylcarbazole
CID 147201109
3-(6-carbazol-9-yldibenzofuran-2-yl)-9-dibenzofuran-4-ylcarbazole
CID 58058989
9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-2-phenylcarbazole
CID 146335876
3-dibenzofuran-2-yl-9-(3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaen-5-yl)carbazole
CID 146647920
9-[7-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]-2-phenylcarbazole;9-[7-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]-3-phenylcarbazole;2,7-diphenyl-9-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]carbazole;3,6-diphenyl-9-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]carbazole;2-phenyl-9-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]carbazole;3-phenyl-9-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]carbazole;9-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]carbazole;9-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]carbazole
CID 158100934
9-dibenzofuran-2-yl-3-[3-(3-phenylphenyl)phenyl]carbazole;3,6-diphenyl-9-[8-[3-(3-phenylphenyl)phenyl]dibenzofuran-4-yl]carbazole;3-[3-(3-phenylphenyl)phenyl]-9-[8-[3-[3-(3-phenylphenyl)phenyl]carbazol-9-yl]dibenzofuran-2-yl]carbazole
CID 158273380
9-dibenzofuran-4-yl-3-phenyl-2-(9-phenylcarbazol-2-yl)carbazole
CID 90321642
3-(9-dibenzofuran-2-ylcarbazol-2-yl)-9-(3,5-diphenylphenyl)carbazole;3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-(3,5-diphenylphenyl)carbazole;3-(9-dibenzofuran-4-ylcarbazol-2-yl)-9-(3,5-diphenylphenyl)carbazole;3-(9-dibenzofuran-2-ylcarbazol-2-yl)-9-(3-phenylphenyl)carbazole;3-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-(3-phenylphenyl)carbazole;3-(9-dibenzofuran-4-ylcarbazol-2-yl)-9-(3-phenylphenyl)carbazole
CID 167701543
N-[4-[4-(9-dibenzofuran-4-ylcarbazol-3-yl)phenyl]phenyl]-N,4-diphenylaniline
CID 90207100
2-(9-dibenzofuran-4-ylcarbazol-3-yl)-9-fluoranthen-3-ylcarbazole
CID 70659172

Frequently Asked Questions

What is the IUPAC name of 2-[3-(4-bromophenyl)phenyl]-9-dibenzofuran-4-ylcarbazole?
The IUPAC name of 2-[3-(4-bromophenyl)phenyl]-9-dibenzofuran-4-ylcarbazole (CID 118505930) is 2-[3-(4-bromophenyl)phenyl]-9-dibenzofuran-4-ylcarbazole.
What is the SMILES notation for 2-[3-(4-bromophenyl)phenyl]-9-dibenzofuran-4-ylcarbazole?
The canonical SMILES for 2-[3-(4-bromophenyl)phenyl]-9-dibenzofuran-4-ylcarbazole is Brc1ccc(-c2cccc(-c3ccc4c5ccccc5n(-c5cccc6c5oc5ccccc56)c4c3)c2)cc1.
What is the InChIKey of 2-[3-(4-bromophenyl)phenyl]-9-dibenzofuran-4-ylcarbazole?
The InChIKey is RXMYFFGATULXNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H22BrNO/c37-27-18-15-23(16-19-27)24-7-5-8-25(21-24)26-17-20-29-28-9-1-3-12-32(28)38(34(29)22-26)33-13-6-11-31-30-10-2-4-14-35(30)39-36(31)33/h1-22H.
What are the key properties of 2-[3-(4-bromophenyl)phenyl]-9-dibenzofuran-4-ylcarbazole?
2-[3-(4-bromophenyl)phenyl]-9-dibenzofuran-4-ylcarbazole has a molecular weight of 564.48 g/mol, XLogP of 10.78, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(4-bromophenyl)phenyl]-9-dibenzofuran-4-ylcarbazole is sourced from PubChem (CID 118505930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).