12-dibenzofuran-1-yl-5-dibenzofuran-4-ylindolo[3,2-c]carbazole

C42H24N2O2 — CID 168744311

IUPAC12-dibenzofuran-1-yl-5-dibenzofuran-4-ylindolo[3,2-c]carbazole
SMILESc1ccc2c(c1)oc1c(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5cccc6oc7ccccc7c56)c34)cccc12
InChIInChI=1S/C42H24N2O2/c1-5-16-31-25(11-1)27-23-24-34-40(41(27)44(31)33-18-10-22-38-39(33)30-14-4-8-21-37(30)45-38)29-13-2-6-17-32(29)43(34)35-19-9-15-28-26-12-3-7-20-36(26)46-42(28)35/h1-24H
InChIKeyXNYSHGIDYGVLSU-UHFFFAOYSA-N
MW588.67 g/mol
LogP11.68
Rot. Bonds2

About 12-dibenzofuran-1-yl-5-dibenzofuran-4-ylindolo[3,2-c]carbazole

12-dibenzofuran-1-yl-5-dibenzofuran-4-ylindolo[3,2-c]carbazole (PubChem CID 168744311) has the molecular formula C42H24N2O2 and a molecular weight of 588.67 g/mol. Its IUPAC name is 12-dibenzofuran-1-yl-5-dibenzofuran-4-ylindolo[3,2-c]carbazole.

Molecular Properties

Compound Name12-dibenzofuran-1-yl-5-dibenzofuran-4-ylindolo[3,2-c]carbazole
PubChem CID168744311
Molecular FormulaC42H24N2O2
Molecular Weight588.67 g/mol
Exact Mass588.18
IUPAC Name12-dibenzofuran-1-yl-5-dibenzofuran-4-ylindolo[3,2-c]carbazole
SMILESc1ccc2c(c1)oc1c(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5cccc6oc7ccccc7c56)c34)cccc12
InChIInChI=1S/C42H24N2O2/c1-5-16-31-25(11-1)27-23-24-34-40(41(27)44(31)33-18-10-22-38-39(33)30-14-4-8-21-37(30)45-38)29-13-2-6-17-32(29)43(34)35-19-9-15-28-26-12-3-7-20-36(26)46-42(28)35/h1-24H
InChIKeyXNYSHGIDYGVLSU-UHFFFAOYSA-N
XLogP11.68
TPSA36.14 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500588.67
LogP ≤ 511.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

12-dibenzofuran-2-yl-5-dibenzofuran-4-ylindolo[3,2-c]carbazole
CID 168744285
12-dibenzofuran-1-yl-5-phenylindolo[3,2-c]carbazole
CID 167029676
12-dibenzofuran-4-yl-5-(4-phenylphenyl)indolo[3,2-c]carbazole
CID 163757322
5-dibenzofuran-4-yl-12-naphthalen-2-ylindolo[3,2-c]carbazole
CID 167029640
12-dibenzofuran-1-yl-5-dibenzothiophen-4-ylindolo[3,2-c]carbazole
CID 168744266
12-(9-pyrimidin-2-ylcarbazol-4-yl)-[1]benzofuro[2,3-a]carbazole
CID 118502599
12-dibenzofuran-4-yl-5-(4-naphthalen-1-ylphenyl)indolo[3,2-c]carbazole
CID 167030154
9-dibenzofuran-1-yl-24-phenyl-9,24-diazahexacyclo[11.11.0.02,10.03,8.014,23.016,21]tetracosa-1(13),2(10),3,5,7,11,14,16,18,20,22-undecaene
CID 122465457
5-phenyl-12-[8-[3-(5-phenylindolo[3,2-c]carbazol-12-yl)carbazol-9-yl]dibenzofuran-4-yl]indolo[3,2-c]carbazole
CID 123179485
9-dibenzofuran-1-yl-3-dibenzofuran-4-ylcarbazole
CID 118504742
9-(9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14,16,18-nonaen-7-yl)-14-phenyl-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 138568922
9-(7-dibenzofuran-4-yldibenzofuran-1-yl)carbazole
CID 170284005

Frequently Asked Questions

What is the IUPAC name of 12-dibenzofuran-1-yl-5-dibenzofuran-4-ylindolo[3,2-c]carbazole?
The IUPAC name of 12-dibenzofuran-1-yl-5-dibenzofuran-4-ylindolo[3,2-c]carbazole (CID 168744311) is 12-dibenzofuran-1-yl-5-dibenzofuran-4-ylindolo[3,2-c]carbazole.
What is the SMILES notation for 12-dibenzofuran-1-yl-5-dibenzofuran-4-ylindolo[3,2-c]carbazole?
The canonical SMILES for 12-dibenzofuran-1-yl-5-dibenzofuran-4-ylindolo[3,2-c]carbazole is c1ccc2c(c1)oc1c(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5cccc6oc7ccccc7c56)c34)cccc12.
What is the InChIKey of 12-dibenzofuran-1-yl-5-dibenzofuran-4-ylindolo[3,2-c]carbazole?
The InChIKey is XNYSHGIDYGVLSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H24N2O2/c1-5-16-31-25(11-1)27-23-24-34-40(41(27)44(31)33-18-10-22-38-39(33)30-14-4-8-21-37(30)45-38)29-13-2-6-17-32(29)43(34)35-19-9-15-28-26-12-3-7-20-36(26)46-42(28)35/h1-24H.
What are the key properties of 12-dibenzofuran-1-yl-5-dibenzofuran-4-ylindolo[3,2-c]carbazole?
12-dibenzofuran-1-yl-5-dibenzofuran-4-ylindolo[3,2-c]carbazole has a molecular weight of 588.67 g/mol, XLogP of 11.68, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 12-dibenzofuran-1-yl-5-dibenzofuran-4-ylindolo[3,2-c]carbazole is sourced from PubChem (CID 168744311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).