11-phenyl-12-(6-phenyldibenzofuran-3-yl)indolo[2,3-a]carbazole

C42H26N2O — CID 122594951

IUPAC11-phenyl-12-(6-phenyldibenzofuran-3-yl)indolo[2,3-a]carbazole
SMILESc1ccc(-c2cccc3c2oc2cc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)ccc23)cc1
InChIInChI=1S/C42H26N2O/c1-3-12-27(13-4-1)30-18-11-19-36-33-23-22-29(26-39(33)45-42(30)36)44-38-21-10-8-17-32(38)35-25-24-34-31-16-7-9-20-37(31)43(40(34)41(35)44)28-14-5-2-6-15-28/h1-26H
InChIKeyROOCVJXLONOGKC-UHFFFAOYSA-N
MW574.68 g/mol
LogP11.45
Rot. Bonds3

About 11-phenyl-12-(6-phenyldibenzofuran-3-yl)indolo[2,3-a]carbazole

11-phenyl-12-(6-phenyldibenzofuran-3-yl)indolo[2,3-a]carbazole (PubChem CID 122594951) has the molecular formula C42H26N2O and a molecular weight of 574.68 g/mol. Its IUPAC name is 11-phenyl-12-(6-phenyldibenzofuran-3-yl)indolo[2,3-a]carbazole.

Molecular Properties

Compound Name11-phenyl-12-(6-phenyldibenzofuran-3-yl)indolo[2,3-a]carbazole
PubChem CID122594951
Molecular FormulaC42H26N2O
Molecular Weight574.68 g/mol
Exact Mass574.20
IUPAC Name11-phenyl-12-(6-phenyldibenzofuran-3-yl)indolo[2,3-a]carbazole
SMILESc1ccc(-c2cccc3c2oc2cc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)ccc23)cc1
InChIInChI=1S/C42H26N2O/c1-3-12-27(13-4-1)30-18-11-19-36-33-23-22-29(26-39(33)45-42(30)36)44-38-21-10-8-17-32(38)35-25-24-34-31-16-7-9-20-37(31)43(40(34)41(35)44)28-14-5-2-6-15-28/h1-26H
InChIKeyROOCVJXLONOGKC-UHFFFAOYSA-N
XLogP11.45
TPSA23.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500574.68
LogP ≤ 511.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

12-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-11-phenylindolo[2,3-a]carbazole
CID 169059257
5-phenyl-3-(11-phenylindolo[2,3-a]carbazol-12-yl)xanthen-9-one
CID 146176130
12-(4-dibenzofuran-4-ylphenyl)-11-phenylindolo[2,3-a]carbazole
CID 71098785
12-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-11-phenylindolo[2,3-a]carbazole
CID 90191508
12-(4-dibenzofuran-4-ylphenyl)-2,11-diphenylindolo[2,3-a]carbazole
CID 126580151
12-(9-dibenzofuran-4-yldibenzofuran-3-yl)-11-phenylindolo[2,3-a]carbazole
CID 170688597
12-(4-carbazol-9-ylphenyl)-11-phenylindolo[2,3-a]carbazole;12-(4-dibenzofuran-4-ylphenyl)-11-phenylindolo[2,3-a]carbazole;11,12-diphenyl-3-(9-phenylcarbazol-3-yl)indolo[2,3-a]carbazole;methane
CID 158881959
12-(4-dibenzofuran-4-ylphenyl)-3,8,11-triphenylindolo[2,3-a]carbazole
CID 90191500
7-dibenzofuran-4-yl-10-phenyl-[1]benzofuro[3,2-b]indole
CID 164828575
11-(4-dibenzofuran-4-ylphenyl)-12-(4,6-diphenylpyrimidin-2-yl)indolo[2,3-a]carbazole
CID 118595440
11,12-bis(4-phenylphenyl)indolo[2,3-a]carbazole;2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole;2-dibenzofuran-4-yl-5,7-diphenylindolo[2,3-b]carbazole;12-(3-phenylphenyl)-11-(4-phenylphenyl)indolo[2,3-a]carbazole
CID 161096514
11-phenyl-12-[4-phenyl-6-(7-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole
CID 156557722

Frequently Asked Questions

What is the IUPAC name of 11-phenyl-12-(6-phenyldibenzofuran-3-yl)indolo[2,3-a]carbazole?
The IUPAC name of 11-phenyl-12-(6-phenyldibenzofuran-3-yl)indolo[2,3-a]carbazole (CID 122594951) is 11-phenyl-12-(6-phenyldibenzofuran-3-yl)indolo[2,3-a]carbazole.
What is the SMILES notation for 11-phenyl-12-(6-phenyldibenzofuran-3-yl)indolo[2,3-a]carbazole?
The canonical SMILES for 11-phenyl-12-(6-phenyldibenzofuran-3-yl)indolo[2,3-a]carbazole is c1ccc(-c2cccc3c2oc2cc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)ccc23)cc1.
What is the InChIKey of 11-phenyl-12-(6-phenyldibenzofuran-3-yl)indolo[2,3-a]carbazole?
The InChIKey is ROOCVJXLONOGKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H26N2O/c1-3-12-27(13-4-1)30-18-11-19-36-33-23-22-29(26-39(33)45-42(30)36)44-38-21-10-8-17-32(38)35-25-24-34-31-16-7-9-20-37(31)43(40(34)41(35)44)28-14-5-2-6-15-28/h1-26H.
What are the key properties of 11-phenyl-12-(6-phenyldibenzofuran-3-yl)indolo[2,3-a]carbazole?
11-phenyl-12-(6-phenyldibenzofuran-3-yl)indolo[2,3-a]carbazole has a molecular weight of 574.68 g/mol, XLogP of 11.45, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 11-phenyl-12-(6-phenyldibenzofuran-3-yl)indolo[2,3-a]carbazole is sourced from PubChem (CID 122594951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).