1-(3-bromo-4-phenylphenyl)-9H-carbazole

C24H16BrN — CID 175063940

IUPAC1-(3-bromo-4-phenylphenyl)-9H-carbazole
SMILESBrc1cc(-c2cccc3c2[nH]c2ccccc23)ccc1-c1ccccc1
InChIInChI=1S/C24H16BrN/c25-22-15-17(13-14-18(22)16-7-2-1-3-8-16)19-10-6-11-21-20-9-4-5-12-23(20)26-24(19)21/h1-15,26H
InChIKeyBLYFLBKIJLSQGU-UHFFFAOYSA-N
MW398.30 g/mol
LogP7.42
Rot. Bonds2

About 1-(3-bromo-4-phenylphenyl)-9H-carbazole

1-(3-bromo-4-phenylphenyl)-9H-carbazole (PubChem CID 175063940) has the molecular formula C24H16BrN and a molecular weight of 398.30 g/mol. Its IUPAC name is 1-(3-bromo-4-phenylphenyl)-9H-carbazole.

Molecular Properties

Compound Name1-(3-bromo-4-phenylphenyl)-9H-carbazole
PubChem CID175063940
Molecular FormulaC24H16BrN
Molecular Weight398.30 g/mol
Exact Mass397.05
IUPAC Name1-(3-bromo-4-phenylphenyl)-9H-carbazole
SMILESBrc1cc(-c2cccc3c2[nH]c2ccccc23)ccc1-c1ccccc1
InChIInChI=1S/C24H16BrN/c25-22-15-17(13-14-18(22)16-7-2-1-3-8-16)19-10-6-11-21-20-9-4-5-12-23(20)26-24(19)21/h1-15,26H
InChIKeyBLYFLBKIJLSQGU-UHFFFAOYSA-N
XLogP7.42
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500398.30
LogP ≤ 57.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

Analyze 1-(3-bromo-4-phenylphenyl)-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-(3,4-diphenylphenyl)-9H-carbazole
CID 141489388
1-[4-(2-bromophenyl)phenyl]-9H-carbazole
CID 175063939
1-[4-[4-[4-[4-(9H-carbazol-1-yl)phenyl]phenyl]phenyl]phenyl]-9H-carbazole
CID 175958773
1-[3-(4-bromophenyl)-5-(9H-carbazol-1-yl)phenyl]-9H-carbazole
CID 67532426
1-(3-triphenylen-2-ylphenyl)-9H-carbazole
CID 129197617
1-[4-[4-(9H-carbazol-1-yl)-2-methylphenyl]-3-methylphenyl]-9H-carbazole
CID 159544666
3-(9H-carbazol-1-yl)-N,N-bis[4-(9H-carbazol-1-yl)phenyl]aniline
CID 141212248
1-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-9H-carbazole
CID 155673306
diphenylphosphane;1-phenyl-9H-carbazole
CID 158040187
3-(9H-carbazol-1-yl)aniline
CID 67501137
1-[4-[[4-(9H-carbazol-1-yl)phenyl]-diphenylmethyl]phenyl]-9H-carbazole
CID 141146048
1-[4-[1-[4-(9H-carbazol-1-yl)phenyl]-2,2-diphenylethenyl]phenyl]-9H-carbazole
CID 155666000

Frequently Asked Questions

What is the IUPAC name of 1-(3-bromo-4-phenylphenyl)-9H-carbazole?
The IUPAC name of 1-(3-bromo-4-phenylphenyl)-9H-carbazole (CID 175063940) is 1-(3-bromo-4-phenylphenyl)-9H-carbazole.
What is the SMILES notation for 1-(3-bromo-4-phenylphenyl)-9H-carbazole?
The canonical SMILES for 1-(3-bromo-4-phenylphenyl)-9H-carbazole is Brc1cc(-c2cccc3c2[nH]c2ccccc23)ccc1-c1ccccc1.
What is the InChIKey of 1-(3-bromo-4-phenylphenyl)-9H-carbazole?
The InChIKey is BLYFLBKIJLSQGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16BrN/c25-22-15-17(13-14-18(22)16-7-2-1-3-8-16)19-10-6-11-21-20-9-4-5-12-23(20)26-24(19)21/h1-15,26H.
What are the key properties of 1-(3-bromo-4-phenylphenyl)-9H-carbazole?
1-(3-bromo-4-phenylphenyl)-9H-carbazole has a molecular weight of 398.30 g/mol, XLogP of 7.42, 2 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-bromo-4-phenylphenyl)-9H-carbazole is sourced from PubChem (CID 175063940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).