1-[3-(4-bromophenyl)-5-(9H-carbazol-1-yl)phenyl]-9H-carbazole

C36H23BrN2 — CID 67532426

IUPAC1-[3-(4-bromophenyl)-5-(9H-carbazol-1-yl)phenyl]-9H-carbazole
SMILESBrc1ccc(-c2cc(-c3cccc4c3[nH]c3ccccc34)cc(-c3cccc4c3[nH]c3ccccc34)c2)cc1
InChIInChI=1S/C36H23BrN2/c37-26-17-15-22(16-18-26)23-19-24(27-9-5-11-31-29-7-1-3-13-33(29)38-35(27)31)21-25(20-23)28-10-6-12-32-30-8-2-4-14-34(30)39-36(28)32/h1-21,38-39H
InChIKeyGYNDWQJYWZWWTG-UHFFFAOYSA-N
MW563.50 g/mol
LogP10.72
Rot. Bonds3

About 1-[3-(4-bromophenyl)-5-(9H-carbazol-1-yl)phenyl]-9H-carbazole

1-[3-(4-bromophenyl)-5-(9H-carbazol-1-yl)phenyl]-9H-carbazole (PubChem CID 67532426) has the molecular formula C36H23BrN2 and a molecular weight of 563.50 g/mol. Its IUPAC name is 1-[3-(4-bromophenyl)-5-(9H-carbazol-1-yl)phenyl]-9H-carbazole.

Molecular Properties

Compound Name1-[3-(4-bromophenyl)-5-(9H-carbazol-1-yl)phenyl]-9H-carbazole
PubChem CID67532426
Molecular FormulaC36H23BrN2
Molecular Weight563.50 g/mol
Exact Mass562.10
IUPAC Name1-[3-(4-bromophenyl)-5-(9H-carbazol-1-yl)phenyl]-9H-carbazole
SMILESBrc1ccc(-c2cc(-c3cccc4c3[nH]c3ccccc34)cc(-c3cccc4c3[nH]c3ccccc34)c2)cc1
InChIInChI=1S/C36H23BrN2/c37-26-17-15-22(16-18-26)23-19-24(27-9-5-11-31-29-7-1-3-13-33(29)38-35(27)31)21-25(20-23)28-10-6-12-32-30-8-2-4-14-34(30)39-36(28)32/h1-21,38-39H
InChIKeyGYNDWQJYWZWWTG-UHFFFAOYSA-N
XLogP10.72
TPSA31.58 Ų
H-Bond Donors2
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500563.50
LogP ≤ 510.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 100

Analyze 1-[3-(4-bromophenyl)-5-(9H-carbazol-1-yl)phenyl]-9H-carbazole 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

1-[4-[4-[4-[4-(9H-carbazol-1-yl)phenyl]phenyl]phenyl]phenyl]-9H-carbazole
CID 175958773
1-[4-(2-bromophenyl)phenyl]-9H-carbazole
CID 175063939
1-(3-triphenylen-2-ylphenyl)-9H-carbazole
CID 129197617
1-(3-bromo-4-phenylphenyl)-9H-carbazole
CID 175063940
1-[2-(9H-carbazol-1-yl)phenyl]-9H-carbazole
CID 66618059
1-[4-[4-(9H-carbazol-1-yl)-2-methylphenyl]-3-methylphenyl]-9H-carbazole
CID 159544666
1-(3,4-diphenylphenyl)-9H-carbazole
CID 141489388
bis[4-(9H-carbazol-1-yl)phenyl]diazene
CID 140514298
3-(9H-carbazol-1-yl)aniline
CID 67501137
1-[4-[1-[4-(9H-carbazol-1-yl)phenyl]-2,2-diphenylethenyl]phenyl]-9H-carbazole
CID 155666000
1-[4-[[4-(9H-carbazol-1-yl)phenyl]-diphenylmethyl]phenyl]-9H-carbazole
CID 141146048
[4-(9H-carbazol-1-yl)phenyl]-triphenylsilane
CID 141080008

Frequently Asked Questions

What is the IUPAC name of 1-[3-(4-bromophenyl)-5-(9H-carbazol-1-yl)phenyl]-9H-carbazole?
The IUPAC name of 1-[3-(4-bromophenyl)-5-(9H-carbazol-1-yl)phenyl]-9H-carbazole (CID 67532426) is 1-[3-(4-bromophenyl)-5-(9H-carbazol-1-yl)phenyl]-9H-carbazole.
What is the SMILES notation for 1-[3-(4-bromophenyl)-5-(9H-carbazol-1-yl)phenyl]-9H-carbazole?
The canonical SMILES for 1-[3-(4-bromophenyl)-5-(9H-carbazol-1-yl)phenyl]-9H-carbazole is Brc1ccc(-c2cc(-c3cccc4c3[nH]c3ccccc34)cc(-c3cccc4c3[nH]c3ccccc34)c2)cc1.
What is the InChIKey of 1-[3-(4-bromophenyl)-5-(9H-carbazol-1-yl)phenyl]-9H-carbazole?
The InChIKey is GYNDWQJYWZWWTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H23BrN2/c37-26-17-15-22(16-18-26)23-19-24(27-9-5-11-31-29-7-1-3-13-33(29)38-35(27)31)21-25(20-23)28-10-6-12-32-30-8-2-4-14-34(30)39-36(28)32/h1-21,38-39H.
What are the key properties of 1-[3-(4-bromophenyl)-5-(9H-carbazol-1-yl)phenyl]-9H-carbazole?
1-[3-(4-bromophenyl)-5-(9H-carbazol-1-yl)phenyl]-9H-carbazole has a molecular weight of 563.50 g/mol, XLogP of 10.72, 3 rotatable bonds, 2 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(4-bromophenyl)-5-(9H-carbazol-1-yl)phenyl]-9H-carbazole is sourced from PubChem (CID 67532426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).