3-carbazol-9-yl-9-phenyl-1-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole

C54H35N3 — CID 138705475

IUPAC3-carbazol-9-yl-9-phenyl-1-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc(-c5cc(-n6c7ccccc7c7ccccc76)cc6c7ccccc7n(-c7ccccc7)c56)cc4)ccc32)cc1
InChIInChI=1S/C54H35N3/c1-3-15-39(16-4-1)55-51-25-13-9-21-44(51)47-33-38(31-32-53(47)55)36-27-29-37(30-28-36)46-34-41(56-49-23-11-7-19-42(49)43-20-8-12-24-50(43)56)35-48-45-22-10-14-26-52(45)57(54(46)48)40-17-5-2-6-18-40/h1-35H
InChIKeyHBGAJFRUPCTYBS-UHFFFAOYSA-N
MW725.90 g/mol
LogP14.31
Rot. Bonds5

About 3-carbazol-9-yl-9-phenyl-1-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole

3-carbazol-9-yl-9-phenyl-1-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole (PubChem CID 138705475) has the molecular formula C54H35N3 and a molecular weight of 725.90 g/mol. Its IUPAC name is 3-carbazol-9-yl-9-phenyl-1-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole.

Molecular Properties

Compound Name3-carbazol-9-yl-9-phenyl-1-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole
PubChem CID138705475
Molecular FormulaC54H35N3
Molecular Weight725.90 g/mol
Exact Mass725.28
IUPAC Name3-carbazol-9-yl-9-phenyl-1-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc(-c5cc(-n6c7ccccc7c7ccccc76)cc6c7ccccc7n(-c7ccccc7)c56)cc4)ccc32)cc1
InChIInChI=1S/C54H35N3/c1-3-15-39(16-4-1)55-51-25-13-9-21-44(51)47-33-38(31-32-53(47)55)36-27-29-37(30-28-36)46-34-41(56-49-23-11-7-19-42(49)43-20-8-12-24-50(43)56)35-48-45-22-10-14-26-52(45)57(54(46)48)40-17-5-2-6-18-40/h1-35H
InChIKeyHBGAJFRUPCTYBS-UHFFFAOYSA-N
XLogP14.31
TPSA14.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500725.90
LogP ≤ 514.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-carbazol-9-yl-9-phenyl-1-[4-(9-phenylcarbazol-3-yl)phenyl]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

9-phenyl-1,3,6-tris(9-phenylcarbazol-3-yl)carbazole
CID 126503545
6-[9-(3,5-diphenylphenyl)carbazol-3-yl]-1,9-diphenylcarbazole
CID 170072372
10-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaene
CID 118186364
1,3-diphenyl-9-(4-phenylphenyl)-6-[4-(6,8,9-triphenylcarbazol-3-yl)phenyl]carbazole
CID 121449228
3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole
CID 20685483
3-[9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 90085403
3,9-diphenyl-6-[9-(3-phenylphenyl)carbazol-3-yl]carbazole;3,9-diphenyl-6-[9-(4-phenylphenyl)carbazol-3-yl]carbazole;1-phenyl-6-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 160580937
3-(9-phenylcarbazol-3-yl)-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 118268216
9-phenyl-3-[4-[3-(4-phenylphenyl)carbazol-9-yl]phenyl]carbazole
CID 126682013
3-(9-phenylcarbazol-3-yl)-9-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazole
CID 174179535
bis(3-carbazol-9-yl-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole);9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole
CID 159641883
3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole
CID 158377312

Frequently Asked Questions

What is the IUPAC name of 3-carbazol-9-yl-9-phenyl-1-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole?
The IUPAC name of 3-carbazol-9-yl-9-phenyl-1-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole (CID 138705475) is 3-carbazol-9-yl-9-phenyl-1-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole.
What is the SMILES notation for 3-carbazol-9-yl-9-phenyl-1-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole?
The canonical SMILES for 3-carbazol-9-yl-9-phenyl-1-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole is c1ccc(-n2c3ccccc3c3cc(-c4ccc(-c5cc(-n6c7ccccc7c7ccccc76)cc6c7ccccc7n(-c7ccccc7)c56)cc4)ccc32)cc1.
What is the InChIKey of 3-carbazol-9-yl-9-phenyl-1-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole?
The InChIKey is HBGAJFRUPCTYBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H35N3/c1-3-15-39(16-4-1)55-51-25-13-9-21-44(51)47-33-38(31-32-53(47)55)36-27-29-37(30-28-36)46-34-41(56-49-23-11-7-19-42(49)43-20-8-12-24-50(43)56)35-48-45-22-10-14-26-52(45)57(54(46)48)40-17-5-2-6-18-40/h1-35H.
What are the key properties of 3-carbazol-9-yl-9-phenyl-1-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole?
3-carbazol-9-yl-9-phenyl-1-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole has a molecular weight of 725.90 g/mol, XLogP of 14.31, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-carbazol-9-yl-9-phenyl-1-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole is sourced from PubChem (CID 138705475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).