5-dibenzofuran-4-yl-7-(4-naphthalen-1-ylphenyl)indolo[2,3-b]carbazole

C46H28N2O — CID 167029628

IUPAC5-dibenzofuran-4-yl-7-(4-naphthalen-1-ylphenyl)indolo[2,3-b]carbazole
SMILESc1ccc2c(-c3ccc(-n4c5ccccc5c5cc6c7ccccc7n(-c7cccc8c7oc7ccccc78)c6cc54)cc3)cccc2c1
InChIInChI=1S/C46H28N2O/c1-2-13-32-29(11-1)12-9-17-33(32)30-23-25-31(26-24-30)47-40-19-6-3-14-34(40)38-27-39-35-15-4-7-20-41(35)48(44(39)28-43(38)47)42-21-10-18-37-36-16-5-8-22-45(36)49-46(37)42/h1-28H
InChIKeyBBRBSYVNQTWZJD-UHFFFAOYSA-N
MW624.74 g/mol
LogP12.60
Rot. Bonds3

About 5-dibenzofuran-4-yl-7-(4-naphthalen-1-ylphenyl)indolo[2,3-b]carbazole

5-dibenzofuran-4-yl-7-(4-naphthalen-1-ylphenyl)indolo[2,3-b]carbazole (PubChem CID 167029628) has the molecular formula C46H28N2O and a molecular weight of 624.74 g/mol. Its IUPAC name is 5-dibenzofuran-4-yl-7-(4-naphthalen-1-ylphenyl)indolo[2,3-b]carbazole.

Molecular Properties

Compound Name5-dibenzofuran-4-yl-7-(4-naphthalen-1-ylphenyl)indolo[2,3-b]carbazole
PubChem CID167029628
Molecular FormulaC46H28N2O
Molecular Weight624.74 g/mol
Exact Mass624.22
IUPAC Name5-dibenzofuran-4-yl-7-(4-naphthalen-1-ylphenyl)indolo[2,3-b]carbazole
SMILESc1ccc2c(-c3ccc(-n4c5ccccc5c5cc6c7ccccc7n(-c7cccc8c7oc7ccccc78)c6cc54)cc3)cccc2c1
InChIInChI=1S/C46H28N2O/c1-2-13-32-29(11-1)12-9-17-33(32)30-23-25-31(26-24-30)47-40-19-6-3-14-34(40)38-27-39-35-15-4-7-20-41(35)48(44(39)28-43(38)47)42-21-10-18-37-36-16-5-8-22-45(36)49-46(37)42/h1-28H
InChIKeyBBRBSYVNQTWZJD-UHFFFAOYSA-N
XLogP12.60
TPSA23.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms49
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500624.74
LogP ≤ 512.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-dibenzofuran-4-yl-14-(4-naphthalen-1-ylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 167029631
12-dibenzofuran-4-yl-5-(4-naphthalen-1-ylphenyl)indolo[3,2-c]carbazole
CID 167030154
7-(4-dibenzofuran-4-ylphenyl)-5-naphthalen-2-ylindolo[2,3-b]carbazole
CID 126580139
3-[9-(2-naphthalen-1-yldibenzofuran-4-yl)carbazol-2-yl]-9-phenylcarbazole
CID 167200561
9-dibenzofuran-4-yl-3-phenyl-2-(9-phenylcarbazol-2-yl)carbazole
CID 90321642
2-dibenzofuran-4-yl-5,7-diphenylindolo[2,3-b]carbazole;5-(4-dibenzofuran-4-ylphenyl)-7-phenylindolo[2,3-b]carbazole;5,7-diphenyl-2-(9-phenylcarbazol-3-yl)indolo[2,3-b]carbazole
CID 160885475
9-dibenzofuran-4-yl-2-phenyl-3-[9-(9-phenylcarbazol-3-yl)carbazol-2-yl]carbazole
CID 90348740
7-(4-dibenzofuran-4-ylphenyl)-5-(11,11-dimethylbenzo[a]fluoren-9-yl)indolo[2,3-b]carbazole
CID 126580144
3-dibenzofuran-4-yl-9-(3,5-dinaphthalen-1-ylphenyl)carbazole
CID 142356757
6-(9-dibenzofuran-4-ylcarbazol-3-yl)-2,9-diphenylcarbazole
CID 170072505
5-(3-dibenzofuran-4-ylphenyl)-7-(4-phenylphenyl)indolo[2,3-b]carbazole
CID 171414718
11-dibenzofuran-4-yl-5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]indolo[3,2-b]carbazole
CID 126629005

Frequently Asked Questions

What is the IUPAC name of 5-dibenzofuran-4-yl-7-(4-naphthalen-1-ylphenyl)indolo[2,3-b]carbazole?
The IUPAC name of 5-dibenzofuran-4-yl-7-(4-naphthalen-1-ylphenyl)indolo[2,3-b]carbazole (CID 167029628) is 5-dibenzofuran-4-yl-7-(4-naphthalen-1-ylphenyl)indolo[2,3-b]carbazole.
What is the SMILES notation for 5-dibenzofuran-4-yl-7-(4-naphthalen-1-ylphenyl)indolo[2,3-b]carbazole?
The canonical SMILES for 5-dibenzofuran-4-yl-7-(4-naphthalen-1-ylphenyl)indolo[2,3-b]carbazole is c1ccc2c(-c3ccc(-n4c5ccccc5c5cc6c7ccccc7n(-c7cccc8c7oc7ccccc78)c6cc54)cc3)cccc2c1.
What is the InChIKey of 5-dibenzofuran-4-yl-7-(4-naphthalen-1-ylphenyl)indolo[2,3-b]carbazole?
The InChIKey is BBRBSYVNQTWZJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H28N2O/c1-2-13-32-29(11-1)12-9-17-33(32)30-23-25-31(26-24-30)47-40-19-6-3-14-34(40)38-27-39-35-15-4-7-20-41(35)48(44(39)28-43(38)47)42-21-10-18-37-36-16-5-8-22-45(36)49-46(37)42/h1-28H.
What are the key properties of 5-dibenzofuran-4-yl-7-(4-naphthalen-1-ylphenyl)indolo[2,3-b]carbazole?
5-dibenzofuran-4-yl-7-(4-naphthalen-1-ylphenyl)indolo[2,3-b]carbazole has a molecular weight of 624.74 g/mol, XLogP of 12.60, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-dibenzofuran-4-yl-7-(4-naphthalen-1-ylphenyl)indolo[2,3-b]carbazole is sourced from PubChem (CID 167029628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).