9-dibenzofuran-4-yl-3-(5-methyl-9-phenyl-5,6-dihydrocarbazol-3-yl)carbazole

C43H30N2O — CID 159339879

IUPAC9-dibenzofuran-4-yl-3-(5-methyl-9-phenyl-5,6-dihydrocarbazol-3-yl)carbazole
SMILESCC1CC=Cc2c1c1cc(-c3ccc4c(c3)c3ccccc3n4-c3cccc4c3oc3ccccc34)ccc1n2-c1ccccc1
InChIInChI=1S/C43H30N2O/c1-27-11-9-18-39-42(27)35-26-29(22-24-38(35)44(39)30-12-3-2-4-13-30)28-21-23-37-34(25-28)31-14-5-7-17-36(31)45(37)40-19-10-16-33-32-15-6-8-20-41(32)46-43(33)40/h2-10,12-27H,11H2,1H3
InChIKeyLFZUSCFPJFRMMG-UHFFFAOYSA-N
MW590.73 g/mol
LogP11.81
Rot. Bonds3

About 9-dibenzofuran-4-yl-3-(5-methyl-9-phenyl-5,6-dihydrocarbazol-3-yl)carbazole

9-dibenzofuran-4-yl-3-(5-methyl-9-phenyl-5,6-dihydrocarbazol-3-yl)carbazole (PubChem CID 159339879) has the molecular formula C43H30N2O and a molecular weight of 590.73 g/mol. Its IUPAC name is 9-dibenzofuran-4-yl-3-(5-methyl-9-phenyl-5,6-dihydrocarbazol-3-yl)carbazole.

Molecular Properties

Compound Name9-dibenzofuran-4-yl-3-(5-methyl-9-phenyl-5,6-dihydrocarbazol-3-yl)carbazole
PubChem CID159339879
Molecular FormulaC43H30N2O
Molecular Weight590.73 g/mol
Exact Mass590.24
IUPAC Name9-dibenzofuran-4-yl-3-(5-methyl-9-phenyl-5,6-dihydrocarbazol-3-yl)carbazole
SMILESCC1CC=Cc2c1c1cc(-c3ccc4c(c3)c3ccccc3n4-c3cccc4c3oc3ccccc34)ccc1n2-c1ccccc1
InChIInChI=1S/C43H30N2O/c1-27-11-9-18-39-42(27)35-26-29(22-24-38(35)44(39)30-12-3-2-4-13-30)28-21-23-37-34(25-28)31-14-5-7-17-36(31)45(37)40-19-10-16-33-32-15-6-8-20-41(32)46-43(33)40/h2-10,12-27H,11H2,1H3
InChIKeyLFZUSCFPJFRMMG-UHFFFAOYSA-N
XLogP11.81
TPSA23.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500590.73
LogP ≤ 511.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-carbazol-9-yl-9-dibenzofuran-4-yl-6-(4-methyl-3,4-dihydrocarbazol-9-yl)carbazole
CID 163632784
6-(9-dibenzofuran-4-ylcarbazol-3-yl)-2,9-diphenylcarbazole
CID 170072505
3-(6-carbazol-9-yldibenzofuran-2-yl)-9-dibenzofuran-4-ylcarbazole
CID 58058989
3-[6-(3,4-dihydrocarbazol-9-yl)dibenzofuran-2-yl]-9-phenylcarbazole
CID 144585567
6-(9-dibenzofuran-4-ylcarbazol-3-yl)-1,9-diphenylcarbazole
CID 170072359
3-[3-(4-carbazol-9-yldibenzofuran-2-yl)phenyl]-9-phenylcarbazole;ethane
CID 144723930
3-dibenzofuran-2-yl-9-(3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaen-5-yl)carbazole
CID 146647920
3-(9-dibenzofuran-4-ylcarbazol-3-yl)-9-(8-phenyldibenzofuran-2-yl)carbazole
CID 123500568
3-dibenzofuran-4-yl-9-(2-dibenzofuran-4-ylphenyl)-6-(9-phenylcarbazol-3-yl)carbazole
CID 177209647
9-(8-dibenzofuran-3-yldibenzofuran-4-yl)-3-phenylcarbazole
CID 147201109
9-dibenzofuran-2-yl-3-[3-(3-phenylphenyl)phenyl]carbazole;3,6-diphenyl-9-[8-[3-(3-phenylphenyl)phenyl]dibenzofuran-4-yl]carbazole;3-[3-(3-phenylphenyl)phenyl]-9-[8-[3-[3-(3-phenylphenyl)phenyl]carbazol-9-yl]dibenzofuran-2-yl]carbazole
CID 158273380
N-[4-[4-(9-dibenzofuran-4-ylcarbazol-3-yl)phenyl]phenyl]-N,4-diphenylaniline
CID 90207100

Frequently Asked Questions

What is the IUPAC name of 9-dibenzofuran-4-yl-3-(5-methyl-9-phenyl-5,6-dihydrocarbazol-3-yl)carbazole?
The IUPAC name of 9-dibenzofuran-4-yl-3-(5-methyl-9-phenyl-5,6-dihydrocarbazol-3-yl)carbazole (CID 159339879) is 9-dibenzofuran-4-yl-3-(5-methyl-9-phenyl-5,6-dihydrocarbazol-3-yl)carbazole.
What is the SMILES notation for 9-dibenzofuran-4-yl-3-(5-methyl-9-phenyl-5,6-dihydrocarbazol-3-yl)carbazole?
The canonical SMILES for 9-dibenzofuran-4-yl-3-(5-methyl-9-phenyl-5,6-dihydrocarbazol-3-yl)carbazole is CC1CC=Cc2c1c1cc(-c3ccc4c(c3)c3ccccc3n4-c3cccc4c3oc3ccccc34)ccc1n2-c1ccccc1.
What is the InChIKey of 9-dibenzofuran-4-yl-3-(5-methyl-9-phenyl-5,6-dihydrocarbazol-3-yl)carbazole?
The InChIKey is LFZUSCFPJFRMMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H30N2O/c1-27-11-9-18-39-42(27)35-26-29(22-24-38(35)44(39)30-12-3-2-4-13-30)28-21-23-37-34(25-28)31-14-5-7-17-36(31)45(37)40-19-10-16-33-32-15-6-8-20-41(32)46-43(33)40/h2-10,12-27H,11H2,1H3.
What are the key properties of 9-dibenzofuran-4-yl-3-(5-methyl-9-phenyl-5,6-dihydrocarbazol-3-yl)carbazole?
9-dibenzofuran-4-yl-3-(5-methyl-9-phenyl-5,6-dihydrocarbazol-3-yl)carbazole has a molecular weight of 590.73 g/mol, XLogP of 11.81, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-dibenzofuran-4-yl-3-(5-methyl-9-phenyl-5,6-dihydrocarbazol-3-yl)carbazole is sourced from PubChem (CID 159339879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).