9-(4-dibenzofuran-4-ylphenyl)-3-methylcarbazole

C31H21NO — CID 129128081

IUPAC9-(4-dibenzofuran-4-ylphenyl)-3-methylcarbazole
SMILESCc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2cccc3c2oc2ccccc23)cc1
InChIInChI=1S/C31H21NO/c1-20-13-18-29-27(19-20)24-7-2-4-11-28(24)32(29)22-16-14-21(15-17-22)23-9-6-10-26-25-8-3-5-12-30(25)33-31(23)26/h2-19H,1H3
InChIKeySKNAMJKFTDLROE-UHFFFAOYSA-N
MW423.52 g/mol
LogP8.66
Rot. Bonds2

About 9-(4-dibenzofuran-4-ylphenyl)-3-methylcarbazole

9-(4-dibenzofuran-4-ylphenyl)-3-methylcarbazole (PubChem CID 129128081) has the molecular formula C31H21NO and a molecular weight of 423.52 g/mol. Its IUPAC name is 9-(4-dibenzofuran-4-ylphenyl)-3-methylcarbazole.

Molecular Properties

Compound Name9-(4-dibenzofuran-4-ylphenyl)-3-methylcarbazole
PubChem CID129128081
Molecular FormulaC31H21NO
Molecular Weight423.52 g/mol
Exact Mass423.16
IUPAC Name9-(4-dibenzofuran-4-ylphenyl)-3-methylcarbazole
SMILESCc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2cccc3c2oc2ccccc23)cc1
InChIInChI=1S/C31H21NO/c1-20-13-18-29-27(19-20)24-7-2-4-11-28(24)32(29)22-16-14-21(15-17-22)23-9-6-10-26-25-8-3-5-12-30(25)33-31(23)26/h2-19H,1H3
InChIKeySKNAMJKFTDLROE-UHFFFAOYSA-N
XLogP8.66
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500423.52
LogP ≤ 58.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-[4-[4-(3,5-dimethylphenyl)phenyl]phenyl]carbazole
CID 134370621
3-dibenzofuran-2-yl-9-(4-dibenzofuran-4-ylphenyl)carbazole
CID 121449395
9-[4-(4-bromophenyl)phenyl]-3-(4-dibenzofuran-4-ylphenyl)carbazole
CID 118402480
3-[8-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 137474197
3-(3-dibenzofuran-2-ylphenyl)-9-(4-dibenzofuran-4-ylphenyl)carbazole
CID 137466609
3-dibenzofuran-4-yl-9-(9-phenylcarbazol-3-yl)carbazole
CID 170132775
2-dibenzofuran-4-yl-5,7-diphenylindolo[2,3-b]carbazole;5-(4-dibenzofuran-4-ylphenyl)-7-phenylindolo[2,3-b]carbazole;5,7-diphenyl-2-(9-phenylcarbazol-3-yl)indolo[2,3-b]carbazole
CID 160885475
3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 134313296
3-[3-[3-(4-dibenzofuran-4-ylphenyl)phenyl]phenyl]-9-phenylcarbazole
CID 121262432
9-[9,10-bis(4-methylphenyl)anthracen-2-yl]-3-dibenzofuran-4-ylcarbazole
CID 87156706
4-(4-bromophenyl)dibenzofuran;3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 158714965
9-(4-carbazol-9-ylphenyl)-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;9-(4-dibenzofuran-4-ylphenyl)-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;9,14-diphenyl-5-(9-phenylcarbazol-3-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
CID 159165938

Frequently Asked Questions

What is the IUPAC name of 9-(4-dibenzofuran-4-ylphenyl)-3-methylcarbazole?
The IUPAC name of 9-(4-dibenzofuran-4-ylphenyl)-3-methylcarbazole (CID 129128081) is 9-(4-dibenzofuran-4-ylphenyl)-3-methylcarbazole.
What is the SMILES notation for 9-(4-dibenzofuran-4-ylphenyl)-3-methylcarbazole?
The canonical SMILES for 9-(4-dibenzofuran-4-ylphenyl)-3-methylcarbazole is Cc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2cccc3c2oc2ccccc23)cc1.
What is the InChIKey of 9-(4-dibenzofuran-4-ylphenyl)-3-methylcarbazole?
The InChIKey is SKNAMJKFTDLROE-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H21NO/c1-20-13-18-29-27(19-20)24-7-2-4-11-28(24)32(29)22-16-14-21(15-17-22)23-9-6-10-26-25-8-3-5-12-30(25)33-31(23)26/h2-19H,1H3.
What are the key properties of 9-(4-dibenzofuran-4-ylphenyl)-3-methylcarbazole?
9-(4-dibenzofuran-4-ylphenyl)-3-methylcarbazole has a molecular weight of 423.52 g/mol, XLogP of 8.66, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-dibenzofuran-4-ylphenyl)-3-methylcarbazole is sourced from PubChem (CID 129128081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).