2-[3-(3-bromophenyl)phenyl]-6,9-diphenylcarbazole

C36H24BrN — CID 90216159

IUPAC2-[3-(3-bromophenyl)phenyl]-6,9-diphenylcarbazole
SMILESBrc1cccc(-c2cccc(-c3ccc4c5cc(-c6ccccc6)ccc5n(-c5ccccc5)c4c3)c2)c1
InChIInChI=1S/C36H24BrN/c37-31-14-8-13-28(22-31)26-11-7-12-27(21-26)30-17-19-33-34-23-29(25-9-3-1-4-10-25)18-20-35(34)38(36(33)24-30)32-15-5-2-6-16-32/h1-24H
InChIKeyYVGLLWYUXVOKTL-UHFFFAOYSA-N
MW550.50 g/mol
LogP10.55
Rot. Bonds4

About 2-[3-(3-bromophenyl)phenyl]-6,9-diphenylcarbazole

2-[3-(3-bromophenyl)phenyl]-6,9-diphenylcarbazole (PubChem CID 90216159) has the molecular formula C36H24BrN and a molecular weight of 550.50 g/mol. Its IUPAC name is 2-[3-(3-bromophenyl)phenyl]-6,9-diphenylcarbazole.

Molecular Properties

Compound Name2-[3-(3-bromophenyl)phenyl]-6,9-diphenylcarbazole
PubChem CID90216159
Molecular FormulaC36H24BrN
Molecular Weight550.50 g/mol
Exact Mass549.11
IUPAC Name2-[3-(3-bromophenyl)phenyl]-6,9-diphenylcarbazole
SMILESBrc1cccc(-c2cccc(-c3ccc4c5cc(-c6ccccc6)ccc5n(-c5ccccc5)c4c3)c2)c1
InChIInChI=1S/C36H24BrN/c37-31-14-8-13-28(22-31)26-11-7-12-27(21-26)30-17-19-33-34-23-29(25-9-3-1-4-10-25)18-20-35(34)38(36(33)24-30)32-15-5-2-6-16-32/h1-24H
InChIKeyYVGLLWYUXVOKTL-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

Analyze 2-[3-(3-bromophenyl)phenyl]-6,9-diphenylcarbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[3-(3-bromophenyl)-5-(9-phenylcarbazol-3-yl)phenyl]-6,9-diphenylcarbazole
CID 118289181
6-[4-(7,9-diphenylcarbazol-3-yl)phenyl]-2,9-diphenylcarbazole;9-phenyl-3-(3-phenylphenyl)-6-[4-[9-phenyl-6-(3-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 162084948
3-[3-(3-bromophenyl)phenyl]-9-(3-phenylphenyl)carbazole
CID 118462638
6-(7,9-diphenylcarbazol-3-yl)-2,9-diphenylcarbazole
CID 121262585
3-(4-carbazol-9-ylphenyl)-9-phenyl-6-[3-(4-phenylphenyl)phenyl]carbazole;3-(4-carbazol-9-ylphenyl)-9-phenyl-6-[4-(3-phenylphenyl)phenyl]carbazole;2-phenyl-9-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 165041671
9-phenyl-3-[4-[2-(3-phenylphenyl)carbazol-9-yl]phenyl]carbazole
CID 126682010
3-(3-bromo-5-phenylphenyl)-9-phenylcarbazole
CID 90030350
3-bromo-9-phenyl-6-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole
CID 141339082
6,9-diphenyl-2-[3-(3-phenylphenyl)-5-triphenylen-2-ylphenyl]carbazole
CID 122492358
9-phenyl-2-[3-phenyl-5-(9-phenylcarbazol-3-yl)phenyl]carbazole
CID 129225606
2-phenyl-9-(4-phenylphenyl)-6-[9-[4-(3-phenylphenyl)phenyl]carbazol-3-yl]carbazole
CID 170072561
2-(6,9-diphenylcarbazol-3-yl)-6,9-diphenylcarbazole;3,9-diphenyl-6-(9-phenylcarbazol-2-yl)carbazole;9-phenyl-3-(9-phenylcarbazol-2-yl)-6-(4-phenylphenyl)carbazole
CID 161163873

Frequently Asked Questions

What is the IUPAC name of 2-[3-(3-bromophenyl)phenyl]-6,9-diphenylcarbazole?
The IUPAC name of 2-[3-(3-bromophenyl)phenyl]-6,9-diphenylcarbazole (CID 90216159) is 2-[3-(3-bromophenyl)phenyl]-6,9-diphenylcarbazole.
What is the SMILES notation for 2-[3-(3-bromophenyl)phenyl]-6,9-diphenylcarbazole?
The canonical SMILES for 2-[3-(3-bromophenyl)phenyl]-6,9-diphenylcarbazole is Brc1cccc(-c2cccc(-c3ccc4c5cc(-c6ccccc6)ccc5n(-c5ccccc5)c4c3)c2)c1.
What is the InChIKey of 2-[3-(3-bromophenyl)phenyl]-6,9-diphenylcarbazole?
The InChIKey is YVGLLWYUXVOKTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H24BrN/c37-31-14-8-13-28(22-31)26-11-7-12-27(21-26)30-17-19-33-34-23-29(25-9-3-1-4-10-25)18-20-35(34)38(36(33)24-30)32-15-5-2-6-16-32/h1-24H.
What are the key properties of 2-[3-(3-bromophenyl)phenyl]-6,9-diphenylcarbazole?
2-[3-(3-bromophenyl)phenyl]-6,9-diphenylcarbazole 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-(3-bromophenyl)phenyl]-6,9-diphenylcarbazole is sourced from PubChem (CID 90216159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).