5-dibenzofuran-4-yl-12-naphthalen-2-ylindolo[3,2-c]carbazole

C40H24N2O — CID 167029640

IUPAC5-dibenzofuran-4-yl-12-naphthalen-2-ylindolo[3,2-c]carbazole
SMILESc1ccc2cc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5cccc6c5oc5ccccc56)c43)ccc2c1
InChIInChI=1S/C40H24N2O/c1-2-11-26-24-27(21-20-25(26)10-1)41-33-16-6-3-12-28(33)30-22-23-35-38(39(30)41)32-14-4-7-17-34(32)42(35)36-18-9-15-31-29-13-5-8-19-37(29)43-40(31)36/h1-24H
InChIKeyFTFDJBVIXCXSOB-UHFFFAOYSA-N
MW548.65 g/mol
LogP10.93
Rot. Bonds2

About 5-dibenzofuran-4-yl-12-naphthalen-2-ylindolo[3,2-c]carbazole

5-dibenzofuran-4-yl-12-naphthalen-2-ylindolo[3,2-c]carbazole (PubChem CID 167029640) has the molecular formula C40H24N2O and a molecular weight of 548.65 g/mol. Its IUPAC name is 5-dibenzofuran-4-yl-12-naphthalen-2-ylindolo[3,2-c]carbazole.

Molecular Properties

Compound Name5-dibenzofuran-4-yl-12-naphthalen-2-ylindolo[3,2-c]carbazole
PubChem CID167029640
Molecular FormulaC40H24N2O
Molecular Weight548.65 g/mol
Exact Mass548.19
IUPAC Name5-dibenzofuran-4-yl-12-naphthalen-2-ylindolo[3,2-c]carbazole
SMILESc1ccc2cc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5cccc6c5oc5ccccc56)c43)ccc2c1
InChIInChI=1S/C40H24N2O/c1-2-11-26-24-27(21-20-25(26)10-1)41-33-16-6-3-12-28(33)30-22-23-35-38(39(30)41)32-14-4-7-17-34(32)42(35)36-18-9-15-31-29-13-5-8-19-37(29)43-40(31)36/h1-24H
InChIKeyFTFDJBVIXCXSOB-UHFFFAOYSA-N
XLogP10.93
TPSA23.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms43
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500548.65
LogP ≤ 510.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-dibenzofuran-4-yl-12-naphthalen-2-ylindolo[3,2-c]carbazole?
The IUPAC name of 5-dibenzofuran-4-yl-12-naphthalen-2-ylindolo[3,2-c]carbazole (CID 167029640) is 5-dibenzofuran-4-yl-12-naphthalen-2-ylindolo[3,2-c]carbazole.
What is the SMILES notation for 5-dibenzofuran-4-yl-12-naphthalen-2-ylindolo[3,2-c]carbazole?
The canonical SMILES for 5-dibenzofuran-4-yl-12-naphthalen-2-ylindolo[3,2-c]carbazole is c1ccc2cc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5cccc6c5oc5ccccc56)c43)ccc2c1.
What is the InChIKey of 5-dibenzofuran-4-yl-12-naphthalen-2-ylindolo[3,2-c]carbazole?
The InChIKey is FTFDJBVIXCXSOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H24N2O/c1-2-11-26-24-27(21-20-25(26)10-1)41-33-16-6-3-12-28(33)30-22-23-35-38(39(30)41)32-14-4-7-17-34(32)42(35)36-18-9-15-31-29-13-5-8-19-37(29)43-40(31)36/h1-24H.
What are the key properties of 5-dibenzofuran-4-yl-12-naphthalen-2-ylindolo[3,2-c]carbazole?
5-dibenzofuran-4-yl-12-naphthalen-2-ylindolo[3,2-c]carbazole has a molecular weight of 548.65 g/mol, XLogP of 10.93, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-dibenzofuran-4-yl-12-naphthalen-2-ylindolo[3,2-c]carbazole is sourced from PubChem (CID 167029640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).