9-[2-(4-dibenzofuran-3-ylphenyl)phenyl]-1-phenylcarbazole

C42H27NO — CID 166037266

IUPAC9-[2-(4-dibenzofuran-3-ylphenyl)phenyl]-1-phenylcarbazole
SMILESc1ccc(-c2cccc3c4ccccc4n(-c4ccccc4-c4ccc(-c5ccc6c(c5)oc5ccccc56)cc4)c23)cc1
InChIInChI=1S/C42H27NO/c1-2-11-29(12-3-1)33-16-10-17-37-34-14-5-8-19-39(34)43(42(33)37)38-18-7-4-13-32(38)30-23-21-28(22-24-30)31-25-26-36-35-15-6-9-20-40(35)44-41(36)27-31/h1-27H
InChIKeyCDGNAYLAORVWAK-UHFFFAOYSA-N
MW561.68 g/mol
LogP11.68
Rot. Bonds4

About 9-[2-(4-dibenzofuran-3-ylphenyl)phenyl]-1-phenylcarbazole

9-[2-(4-dibenzofuran-3-ylphenyl)phenyl]-1-phenylcarbazole (PubChem CID 166037266) has the molecular formula C42H27NO and a molecular weight of 561.68 g/mol. Its IUPAC name is 9-[2-(4-dibenzofuran-3-ylphenyl)phenyl]-1-phenylcarbazole.

Molecular Properties

Compound Name9-[2-(4-dibenzofuran-3-ylphenyl)phenyl]-1-phenylcarbazole
PubChem CID166037266
Molecular FormulaC42H27NO
Molecular Weight561.68 g/mol
Exact Mass561.21
IUPAC Name9-[2-(4-dibenzofuran-3-ylphenyl)phenyl]-1-phenylcarbazole
SMILESc1ccc(-c2cccc3c4ccccc4n(-c4ccccc4-c4ccc(-c5ccc6c(c5)oc5ccccc56)cc4)c23)cc1
InChIInChI=1S/C42H27NO/c1-2-11-29(12-3-1)33-16-10-17-37-34-14-5-8-19-39(34)43(42(33)37)38-18-7-4-13-32(38)30-23-21-28(22-24-30)31-25-26-36-35-15-6-9-20-40(35)44-41(36)27-31/h1-27H
InChIKeyCDGNAYLAORVWAK-UHFFFAOYSA-N
XLogP11.68
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500561.68
LogP ≤ 511.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-[4-(4-dibenzofuran-3-ylphenyl)phenyl]-1-phenylcarbazole
CID 163676020
N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-(3-dibenzofuran-3-ylphenyl)-3-phenylaniline
CID 153314590
1-dibenzofuran-3-yl-9-phenylcarbazole
CID 137466533
N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-(4-dibenzofuran-3-ylphenyl)-2-(4-phenylphenyl)aniline
CID 153314946
N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]-3-(3-phenylphenyl)aniline
CID 153314841
9-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)-1-(7-phenyldibenzofuran-2-yl)carbazole
CID 167309895
9-[2-[4-(4-dibenzofuran-2-ylphenyl)phenyl]phenyl]-2,7-diphenylcarbazole
CID 163423190
4-[9-[4-(4-dibenzofuran-3-ylphenyl)phenyl]carbazol-1-yl]-9-phenylcarbazole
CID 166510001
1-[7-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 139342651
6-[4-[4,6-di(dibenzofuran-3-yl)-1,3,5-triazin-2-yl]phenyl]-1,9-diphenylcarbazole
CID 155201239
12-[2-[4-phenyl-6-(9-phenyldibenzofuran-3-yl)-1,3,5-triazin-2-yl]phenyl]-[1]benzofuro[3,2-a]carbazole
CID 164932814
3-dibenzofuran-3-yl-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 165007385

Frequently Asked Questions

What is the IUPAC name of 9-[2-(4-dibenzofuran-3-ylphenyl)phenyl]-1-phenylcarbazole?
The IUPAC name of 9-[2-(4-dibenzofuran-3-ylphenyl)phenyl]-1-phenylcarbazole (CID 166037266) is 9-[2-(4-dibenzofuran-3-ylphenyl)phenyl]-1-phenylcarbazole.
What is the SMILES notation for 9-[2-(4-dibenzofuran-3-ylphenyl)phenyl]-1-phenylcarbazole?
The canonical SMILES for 9-[2-(4-dibenzofuran-3-ylphenyl)phenyl]-1-phenylcarbazole is c1ccc(-c2cccc3c4ccccc4n(-c4ccccc4-c4ccc(-c5ccc6c(c5)oc5ccccc56)cc4)c23)cc1.
What is the InChIKey of 9-[2-(4-dibenzofuran-3-ylphenyl)phenyl]-1-phenylcarbazole?
The InChIKey is CDGNAYLAORVWAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H27NO/c1-2-11-29(12-3-1)33-16-10-17-37-34-14-5-8-19-39(34)43(42(33)37)38-18-7-4-13-32(38)30-23-21-28(22-24-30)31-25-26-36-35-15-6-9-20-40(35)44-41(36)27-31/h1-27H.
What are the key properties of 9-[2-(4-dibenzofuran-3-ylphenyl)phenyl]-1-phenylcarbazole?
9-[2-(4-dibenzofuran-3-ylphenyl)phenyl]-1-phenylcarbazole has a molecular weight of 561.68 g/mol, XLogP of 11.68, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2-(4-dibenzofuran-3-ylphenyl)phenyl]-1-phenylcarbazole is sourced from PubChem (CID 166037266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).