3-[2-(2-dibenzofuran-4-ylphenoxy)phenyl]-9-phenylcarbazole

C42H27NO2 — CID 145345442

IUPAC3-[2-(2-dibenzofuran-4-ylphenoxy)phenyl]-9-phenylcarbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccccc4Oc4ccccc4-c4cccc5c4oc4ccccc45)ccc32)cc1
InChIInChI=1S/C42H27NO2/c1-2-13-29(14-3-1)43-37-21-8-4-16-31(37)36-27-28(25-26-38(36)43)30-15-5-9-22-39(30)44-40-23-10-6-17-32(40)34-19-12-20-35-33-18-7-11-24-41(33)45-42(34)35/h1-27H
InChIKeyJLSFOIKEXQIPFI-UHFFFAOYSA-N
MW577.68 g/mol
LogP11.81
Rot. Bonds5

About 3-[2-(2-dibenzofuran-4-ylphenoxy)phenyl]-9-phenylcarbazole

3-[2-(2-dibenzofuran-4-ylphenoxy)phenyl]-9-phenylcarbazole (PubChem CID 145345442) has the molecular formula C42H27NO2 and a molecular weight of 577.68 g/mol. Its IUPAC name is 3-[2-(2-dibenzofuran-4-ylphenoxy)phenyl]-9-phenylcarbazole.

Molecular Properties

Compound Name3-[2-(2-dibenzofuran-4-ylphenoxy)phenyl]-9-phenylcarbazole
PubChem CID145345442
Molecular FormulaC42H27NO2
Molecular Weight577.68 g/mol
Exact Mass577.20
IUPAC Name3-[2-(2-dibenzofuran-4-ylphenoxy)phenyl]-9-phenylcarbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccccc4Oc4ccccc4-c4cccc5c4oc4ccccc45)ccc32)cc1
InChIInChI=1S/C42H27NO2/c1-2-13-29(14-3-1)43-37-21-8-4-16-31(37)36-27-28(25-26-38(36)43)30-15-5-9-22-39(30)44-40-23-10-6-17-32(40)34-19-12-20-35-33-18-7-11-24-41(33)45-42(34)35/h1-27H
InChIKeyJLSFOIKEXQIPFI-UHFFFAOYSA-N
XLogP11.81
TPSA27.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500577.68
LogP ≤ 511.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-dibenzofuran-4-yl-9-(9-phenylcarbazol-3-yl)carbazole
CID 170132775
3-dibenzofuran-4-yl-9-(3-dibenzofuran-4-ylphenyl)-6-(9-phenylcarbazol-3-yl)carbazole
CID 121449361
3-dibenzofuran-4-yl-9-[3-(3-dibenzofuran-4-ylcarbazol-9-yl)phenyl]carbazole
CID 71004884
3-dibenzofuran-4-yl-9-(2-dibenzofuran-4-ylphenyl)-6-(9-phenylcarbazol-3-yl)carbazole
CID 177209647
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-[3-[3-(4-dibenzofuran-4-ylphenyl)phenyl]phenyl]-9-phenylcarbazole
CID 121262432
3-[9-(4-dibenzofuran-4-ylnaphthalen-1-yl)carbazol-3-yl]-9-phenylcarbazole
CID 126753261
3-[8-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 137474197
3-bromo-6-dibenzofuran-4-yl-9-phenylcarbazole
CID 90089515
3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 134313296
3-dibenzofuran-4-yl-9-[4-(2,3,6,7-tetramethyl-10-phenylanthracen-9-yl)phenyl]carbazole
CID 90180761
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 3-[2-(2-dibenzofuran-4-ylphenoxy)phenyl]-9-phenylcarbazole?
The IUPAC name of 3-[2-(2-dibenzofuran-4-ylphenoxy)phenyl]-9-phenylcarbazole (CID 145345442) is 3-[2-(2-dibenzofuran-4-ylphenoxy)phenyl]-9-phenylcarbazole.
What is the SMILES notation for 3-[2-(2-dibenzofuran-4-ylphenoxy)phenyl]-9-phenylcarbazole?
The canonical SMILES for 3-[2-(2-dibenzofuran-4-ylphenoxy)phenyl]-9-phenylcarbazole is c1ccc(-n2c3ccccc3c3cc(-c4ccccc4Oc4ccccc4-c4cccc5c4oc4ccccc45)ccc32)cc1.
What is the InChIKey of 3-[2-(2-dibenzofuran-4-ylphenoxy)phenyl]-9-phenylcarbazole?
The InChIKey is JLSFOIKEXQIPFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H27NO2/c1-2-13-29(14-3-1)43-37-21-8-4-16-31(37)36-27-28(25-26-38(36)43)30-15-5-9-22-39(30)44-40-23-10-6-17-32(40)34-19-12-20-35-33-18-7-11-24-41(33)45-42(34)35/h1-27H.
What are the key properties of 3-[2-(2-dibenzofuran-4-ylphenoxy)phenyl]-9-phenylcarbazole?
3-[2-(2-dibenzofuran-4-ylphenoxy)phenyl]-9-phenylcarbazole has a molecular weight of 577.68 g/mol, XLogP of 11.81, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-dibenzofuran-4-ylphenoxy)phenyl]-9-phenylcarbazole is sourced from PubChem (CID 145345442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).