3-dibenzofuran-4-yl-9-[3-(6-methyl-1-phenylbenzimidazol-2-yl)phenyl]carbazole

C44H29N3O — CID 67819112

IUPAC3-dibenzofuran-4-yl-9-[3-(6-methyl-1-phenylbenzimidazol-2-yl)phenyl]carbazole
SMILESCc1ccc2nc(-c3cccc(-n4c5ccccc5c5cc(-c6cccc7c6oc6ccccc67)ccc54)c3)n(-c3ccccc3)c2c1
InChIInChI=1S/C44H29N3O/c1-28-21-23-38-41(25-28)47(31-12-3-2-4-13-31)44(45-38)30-11-9-14-32(26-30)46-39-19-7-5-15-34(39)37-27-29(22-24-40(37)46)33-17-10-18-36-35-16-6-8-20-42(35)48-43(33)36/h2-27H,1H3
InChIKeyMFEGYRMJYQYSQM-UHFFFAOYSA-N
MW615.74 g/mol
LogP11.66
Rot. Bonds4

About 3-dibenzofuran-4-yl-9-[3-(6-methyl-1-phenylbenzimidazol-2-yl)phenyl]carbazole

3-dibenzofuran-4-yl-9-[3-(6-methyl-1-phenylbenzimidazol-2-yl)phenyl]carbazole (PubChem CID 67819112) has the molecular formula C44H29N3O and a molecular weight of 615.74 g/mol. Its IUPAC name is 3-dibenzofuran-4-yl-9-[3-(6-methyl-1-phenylbenzimidazol-2-yl)phenyl]carbazole.

Molecular Properties

Compound Name3-dibenzofuran-4-yl-9-[3-(6-methyl-1-phenylbenzimidazol-2-yl)phenyl]carbazole
PubChem CID67819112
Molecular FormulaC44H29N3O
Molecular Weight615.74 g/mol
Exact Mass615.23
IUPAC Name3-dibenzofuran-4-yl-9-[3-(6-methyl-1-phenylbenzimidazol-2-yl)phenyl]carbazole
SMILESCc1ccc2nc(-c3cccc(-n4c5ccccc5c5cc(-c6cccc7c6oc6ccccc67)ccc54)c3)n(-c3ccccc3)c2c1
InChIInChI=1S/C44H29N3O/c1-28-21-23-38-41(25-28)47(31-12-3-2-4-13-31)44(45-38)30-11-9-14-32(26-30)46-39-19-7-5-15-34(39)37-27-29(22-24-40(37)46)33-17-10-18-36-35-16-6-8-20-42(35)48-43(33)36/h2-27H,1H3
InChIKeyMFEGYRMJYQYSQM-UHFFFAOYSA-N
XLogP11.66
TPSA35.89 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500615.74
LogP ≤ 511.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-dibenzofuran-4-yl-9-[3-(6-methyl-1-phenylbenzimidazol-2-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

3-dibenzofuran-4-yl-9-[3-(1-naphthalen-2-ylbenzimidazol-2-yl)phenyl]carbazole
CID 67818381
3-dibenzofuran-4-yl-9-(3-dibenzofuran-4-ylphenyl)-6-(9-phenylcarbazol-3-yl)carbazole
CID 121449361
3-dibenzofuran-4-yl-9-[4-[4-(3-methylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole
CID 170251153
3-dibenzofuran-4-yl-9-(9-phenylcarbazol-3-yl)carbazole
CID 170132775
9-[4-[1-(4-tert-butylphenyl)benzimidazol-2-yl]phenyl]-3-dibenzofuran-4-ylcarbazole;3-dibenzofuran-4-yl-9-[4-[1-(2-methylphenyl)benzimidazol-2-yl]phenyl]carbazole;3-dibenzofuran-4-yl-9-[4-[1-(3-methylphenyl)benzimidazol-2-yl]phenyl]carbazole;3-dibenzofuran-4-yl-9-[4-[1-(4-methylphenyl)benzimidazol-2-yl]phenyl]carbazole
CID 161304554
3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 134313296
3-dibenzofuran-4-yl-9-[3-(3-dibenzofuran-4-ylcarbazol-9-yl)phenyl]carbazole
CID 71004884
9-[3-(8-carbazol-9-yldibenzofuran-4-yl)phenyl]-3-dibenzofuran-4-ylcarbazole
CID 58099745
9-(4-dibenzofuran-4-ylphenyl)-3-methylcarbazole
CID 129128081
3-[4-(3-dibenzofuran-4-ylphenyl)-2-phenylquinazolin-6-yl]-9-phenylcarbazole
CID 145159061
9-[3-(1-phenylbenzimidazol-2-yl)phenyl]-3-(2,6,8-triphenyldibenzofuran-4-yl)carbazole
CID 67818598
5-(3-dibenzofuran-4-ylphenyl)-7-(4-phenylphenyl)indolo[2,3-b]carbazole
CID 171414718

Frequently Asked Questions

What is the IUPAC name of 3-dibenzofuran-4-yl-9-[3-(6-methyl-1-phenylbenzimidazol-2-yl)phenyl]carbazole?
The IUPAC name of 3-dibenzofuran-4-yl-9-[3-(6-methyl-1-phenylbenzimidazol-2-yl)phenyl]carbazole (CID 67819112) is 3-dibenzofuran-4-yl-9-[3-(6-methyl-1-phenylbenzimidazol-2-yl)phenyl]carbazole.
What is the SMILES notation for 3-dibenzofuran-4-yl-9-[3-(6-methyl-1-phenylbenzimidazol-2-yl)phenyl]carbazole?
The canonical SMILES for 3-dibenzofuran-4-yl-9-[3-(6-methyl-1-phenylbenzimidazol-2-yl)phenyl]carbazole is Cc1ccc2nc(-c3cccc(-n4c5ccccc5c5cc(-c6cccc7c6oc6ccccc67)ccc54)c3)n(-c3ccccc3)c2c1.
What is the InChIKey of 3-dibenzofuran-4-yl-9-[3-(6-methyl-1-phenylbenzimidazol-2-yl)phenyl]carbazole?
The InChIKey is MFEGYRMJYQYSQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H29N3O/c1-28-21-23-38-41(25-28)47(31-12-3-2-4-13-31)44(45-38)30-11-9-14-32(26-30)46-39-19-7-5-15-34(39)37-27-29(22-24-40(37)46)33-17-10-18-36-35-16-6-8-20-42(35)48-43(33)36/h2-27H,1H3.
What are the key properties of 3-dibenzofuran-4-yl-9-[3-(6-methyl-1-phenylbenzimidazol-2-yl)phenyl]carbazole?
3-dibenzofuran-4-yl-9-[3-(6-methyl-1-phenylbenzimidazol-2-yl)phenyl]carbazole has a molecular weight of 615.74 g/mol, XLogP of 11.66, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-dibenzofuran-4-yl-9-[3-(6-methyl-1-phenylbenzimidazol-2-yl)phenyl]carbazole is sourced from PubChem (CID 67819112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).