9-[4-(4-dibenzofuran-1-ylphenyl)phenyl]-3,6-dimethylcarbazole

C38H27NO — CID 163433244

IUPAC9-[4-(4-dibenzofuran-1-ylphenyl)phenyl]-3,6-dimethylcarbazole
SMILESCc1ccc2c(c1)c1cc(C)ccc1n2-c1ccc(-c2ccc(-c3cccc4oc5ccccc5c34)cc2)cc1
InChIInChI=1S/C38H27NO/c1-24-10-20-34-32(22-24)33-23-25(2)11-21-35(33)39(34)29-18-16-27(17-19-29)26-12-14-28(15-13-26)30-7-5-9-37-38(30)31-6-3-4-8-36(31)40-37/h3-23H,1-2H3
InChIKeyAJBAPQFTSBWTOC-UHFFFAOYSA-N
MW513.64 g/mol
LogP10.63
Rot. Bonds3

About 9-[4-(4-dibenzofuran-1-ylphenyl)phenyl]-3,6-dimethylcarbazole

9-[4-(4-dibenzofuran-1-ylphenyl)phenyl]-3,6-dimethylcarbazole (PubChem CID 163433244) has the molecular formula C38H27NO and a molecular weight of 513.64 g/mol. Its IUPAC name is 9-[4-(4-dibenzofuran-1-ylphenyl)phenyl]-3,6-dimethylcarbazole.

Molecular Properties

Compound Name9-[4-(4-dibenzofuran-1-ylphenyl)phenyl]-3,6-dimethylcarbazole
PubChem CID163433244
Molecular FormulaC38H27NO
Molecular Weight513.64 g/mol
Exact Mass513.21
IUPAC Name9-[4-(4-dibenzofuran-1-ylphenyl)phenyl]-3,6-dimethylcarbazole
SMILESCc1ccc2c(c1)c1cc(C)ccc1n2-c1ccc(-c2ccc(-c3cccc4oc5ccccc5c34)cc2)cc1
InChIInChI=1S/C38H27NO/c1-24-10-20-34-32(22-24)33-23-25(2)11-21-35(33)39(34)29-18-16-27(17-19-29)26-12-14-28(15-13-26)30-7-5-9-37-38(30)31-6-3-4-8-36(31)40-37/h3-23H,1-2H3
InChIKeyAJBAPQFTSBWTOC-UHFFFAOYSA-N
XLogP10.63
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500513.64
LogP ≤ 510.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-[4-[4-(4-dibenzofuran-1-ylphenyl)phenyl]phenyl]carbazole
CID 163638937
9-[4-(4-dibenzofuran-1-ylphenyl)phenyl]-3-(3-phenylphenyl)carbazole
CID 167329299
9-(4-dibenzofuran-4-ylphenyl)-3-methylcarbazole
CID 129128081
3-methyl-9-[4-[9-(4-methylphenyl)carbazol-4-yl]phenyl]carbazole
CID 174182442
3-dibenzofuran-1-yl-5-methyl-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 142352819
3-(9-phenylcarbazol-3-yl)-9-[9-(4-phenylphenyl)dibenzofuran-2-yl]carbazole
CID 177077416
4-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(4-dibenzofuran-1-ylphenyl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline
CID 155398444
9-[4-(4-dibenzofuran-1-ylphenyl)phenyl]-1-phenylcarbazole
CID 163433245
3-[9-(4-methylphenyl)carbazol-3-yl]-9-[9-(2,3,4,5,6-pentadeuteriophenyl)dibenzofuran-3-yl]carbazole
CID 177077405
N-(4-carbazol-9-ylphenyl)-N-(4-dibenzofuran-1-ylphenyl)-3-(4-phenylphenyl)aniline
CID 155397977
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(4-dibenzofuran-1-ylphenyl)-2-(2-phenylphenyl)aniline
CID 155398224
N-(4-carbazol-9-ylphenyl)-N-(4-dibenzofuran-1-ylphenyl)-3-phenylaniline
CID 155649256

Frequently Asked Questions

What is the IUPAC name of 9-[4-(4-dibenzofuran-1-ylphenyl)phenyl]-3,6-dimethylcarbazole?
The IUPAC name of 9-[4-(4-dibenzofuran-1-ylphenyl)phenyl]-3,6-dimethylcarbazole (CID 163433244) is 9-[4-(4-dibenzofuran-1-ylphenyl)phenyl]-3,6-dimethylcarbazole.
What is the SMILES notation for 9-[4-(4-dibenzofuran-1-ylphenyl)phenyl]-3,6-dimethylcarbazole?
The canonical SMILES for 9-[4-(4-dibenzofuran-1-ylphenyl)phenyl]-3,6-dimethylcarbazole is Cc1ccc2c(c1)c1cc(C)ccc1n2-c1ccc(-c2ccc(-c3cccc4oc5ccccc5c34)cc2)cc1.
What is the InChIKey of 9-[4-(4-dibenzofuran-1-ylphenyl)phenyl]-3,6-dimethylcarbazole?
The InChIKey is AJBAPQFTSBWTOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H27NO/c1-24-10-20-34-32(22-24)33-23-25(2)11-21-35(33)39(34)29-18-16-27(17-19-29)26-12-14-28(15-13-26)30-7-5-9-37-38(30)31-6-3-4-8-36(31)40-37/h3-23H,1-2H3.
What are the key properties of 9-[4-(4-dibenzofuran-1-ylphenyl)phenyl]-3,6-dimethylcarbazole?
9-[4-(4-dibenzofuran-1-ylphenyl)phenyl]-3,6-dimethylcarbazole has a molecular weight of 513.64 g/mol, XLogP of 10.63, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-(4-dibenzofuran-1-ylphenyl)phenyl]-3,6-dimethylcarbazole is sourced from PubChem (CID 163433244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).