2-[3-(2-bromophenyl)phenyl]-9-(4-phenylphenyl)carbazole

C36H24BrN — CID 90216170

IUPAC2-[3-(2-bromophenyl)phenyl]-9-(4-phenylphenyl)carbazole
SMILESBrc1ccccc1-c1cccc(-c2ccc3c4ccccc4n(-c4ccc(-c5ccccc5)cc4)c3c2)c1
InChIInChI=1S/C36H24BrN/c37-34-15-6-4-13-31(34)29-12-8-11-27(23-29)28-19-22-33-32-14-5-7-16-35(32)38(36(33)24-28)30-20-17-26(18-21-30)25-9-2-1-3-10-25/h1-24H
InChIKeyXSQSQWPLXORVRY-UHFFFAOYSA-N
MW550.50 g/mol
LogP10.55
Rot. Bonds4

About 2-[3-(2-bromophenyl)phenyl]-9-(4-phenylphenyl)carbazole

2-[3-(2-bromophenyl)phenyl]-9-(4-phenylphenyl)carbazole (PubChem CID 90216170) has the molecular formula C36H24BrN and a molecular weight of 550.50 g/mol. Its IUPAC name is 2-[3-(2-bromophenyl)phenyl]-9-(4-phenylphenyl)carbazole.

Molecular Properties

Compound Name2-[3-(2-bromophenyl)phenyl]-9-(4-phenylphenyl)carbazole
PubChem CID90216170
Molecular FormulaC36H24BrN
Molecular Weight550.50 g/mol
Exact Mass549.11
IUPAC Name2-[3-(2-bromophenyl)phenyl]-9-(4-phenylphenyl)carbazole
SMILESBrc1ccccc1-c1cccc(-c2ccc3c4ccccc4n(-c4ccc(-c5ccccc5)cc4)c3c2)c1
InChIInChI=1S/C36H24BrN/c37-34-15-6-4-13-31(34)29-12-8-11-27(23-29)28-19-22-33-32-14-5-7-16-35(32)38(36(33)24-28)30-20-17-26(18-21-30)25-9-2-1-3-10-25/h1-24H
InChIKeyXSQSQWPLXORVRY-UHFFFAOYSA-N
XLogP10.55
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500550.50
LogP ≤ 510.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[3-(2-bromophenyl)phenyl]-9-(3-phenylphenyl)carbazole
CID 90216183
2-[4-(2-bromophenyl)phenyl]-9-[4-(2-phenylphenyl)phenyl]carbazole
CID 118265947
2-[9-(4-phenylphenyl)carbazol-2-yl]-9-[4-(3-phenylphenyl)phenyl]carbazole
CID 138747135
2-(2-bromophenyl)-9-(2,4-diphenylphenyl)carbazole;2-(2-bromophenyl)-9-(2,5-diphenylphenyl)carbazole;2-(2-bromophenyl)-9-(2,6-diphenylphenyl)carbazole;2-(2-bromophenyl)-9-[4-(3-phenylphenyl)phenyl]carbazole
CID 160975340
2-[2-(2-bromophenyl)phenyl]-9-(2,5-diphenylphenyl)carbazole;2-[2-(2-bromophenyl)phenyl]-9-(2,6-diphenylphenyl)carbazole;2-[2-(2-bromophenyl)phenyl]-9-[4-(2-phenylphenyl)phenyl]carbazole;2-[2-(2-bromophenyl)phenyl]-9-[4-(3-phenylphenyl)phenyl]carbazole;methane
CID 158973335
9-[4-(3,5-diphenylphenyl)phenyl]-2-[9-[4-(3,5-diphenylphenyl)phenyl]carbazol-2-yl]carbazole
CID 135166087
2-[2-(4-methylphenyl)phenyl]-9-[4-(3-phenylphenyl)phenyl]carbazole
CID 118337077
2-(2-bromophenyl)-7,9-diphenylcarbazole;2-(2-bromophenyl)-9-naphthalen-1-ylcarbazole;2-(2-bromophenyl)-9-naphthalen-2-ylcarbazole;2-(2-bromophenyl)-9-phenylcarbazole;2-(2-bromophenyl)-9-(4-phenylphenyl)carbazole
CID 157414448
2-phenyl-9-[2-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]carbazole
CID 166037119
2-[2-(9-phenylcarbazol-2-yl)phenyl]-9-(3-phenylphenyl)carbazole
CID 162495147
2-phenyl-9-(4-phenylphenyl)-6-[9-[4-(3-phenylphenyl)phenyl]carbazol-3-yl]carbazole
CID 170072561
2-[2-(2-bromophenyl)phenyl]-9-[2-(2-phenylphenyl)phenyl]carbazole;2-[2-(2-bromophenyl)phenyl]-9-[2-(3-phenylphenyl)phenyl]carbazole;2-[2-(2-bromophenyl)phenyl]-9-[3-(2-phenylphenyl)phenyl]carbazole;2-[2-(2-bromophenyl)phenyl]-9-[3-(3-phenylphenyl)phenyl]carbazole
CID 159170959

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-bromophenyl)phenyl]-9-(4-phenylphenyl)carbazole?
The IUPAC name of 2-[3-(2-bromophenyl)phenyl]-9-(4-phenylphenyl)carbazole (CID 90216170) is 2-[3-(2-bromophenyl)phenyl]-9-(4-phenylphenyl)carbazole.
What is the SMILES notation for 2-[3-(2-bromophenyl)phenyl]-9-(4-phenylphenyl)carbazole?
The canonical SMILES for 2-[3-(2-bromophenyl)phenyl]-9-(4-phenylphenyl)carbazole is Brc1ccccc1-c1cccc(-c2ccc3c4ccccc4n(-c4ccc(-c5ccccc5)cc4)c3c2)c1.
What is the InChIKey of 2-[3-(2-bromophenyl)phenyl]-9-(4-phenylphenyl)carbazole?
The InChIKey is XSQSQWPLXORVRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H24BrN/c37-34-15-6-4-13-31(34)29-12-8-11-27(23-29)28-19-22-33-32-14-5-7-16-35(32)38(36(33)24-28)30-20-17-26(18-21-30)25-9-2-1-3-10-25/h1-24H.
What are the key properties of 2-[3-(2-bromophenyl)phenyl]-9-(4-phenylphenyl)carbazole?
2-[3-(2-bromophenyl)phenyl]-9-(4-phenylphenyl)carbazole has a molecular weight of 550.50 g/mol, XLogP of 10.55, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-bromophenyl)phenyl]-9-(4-phenylphenyl)carbazole is sourced from PubChem (CID 90216170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).