9-(2-dibenzofuran-2-ylphenyl)-3,6-bis(3,5-dimethylphenyl)carbazole

C46H35NO — CID 169284782

IUPAC9-(2-dibenzofuran-2-ylphenyl)-3,6-bis(3,5-dimethylphenyl)carbazole
SMILESCc1cc(C)cc(-c2ccc3c(c2)c2cc(-c4cc(C)cc(C)c4)ccc2n3-c2ccccc2-c2ccc3oc4ccccc4c3c2)c1
InChIInChI=1S/C46H35NO/c1-28-19-29(2)22-35(21-28)32-13-16-43-39(25-32)40-26-33(36-23-30(3)20-31(4)24-36)14-17-44(40)47(43)42-11-7-5-9-37(42)34-15-18-46-41(27-34)38-10-6-8-12-45(38)48-46/h5-27H,1-4H3
InChIKeyJSRIDYXHPQKIDS-UHFFFAOYSA-N
MW617.79 g/mol
LogP12.92
Rot. Bonds4

About 9-(2-dibenzofuran-2-ylphenyl)-3,6-bis(3,5-dimethylphenyl)carbazole

9-(2-dibenzofuran-2-ylphenyl)-3,6-bis(3,5-dimethylphenyl)carbazole (PubChem CID 169284782) has the molecular formula C46H35NO and a molecular weight of 617.79 g/mol. Its IUPAC name is 9-(2-dibenzofuran-2-ylphenyl)-3,6-bis(3,5-dimethylphenyl)carbazole.

Molecular Properties

Compound Name9-(2-dibenzofuran-2-ylphenyl)-3,6-bis(3,5-dimethylphenyl)carbazole
PubChem CID169284782
Molecular FormulaC46H35NO
Molecular Weight617.79 g/mol
Exact Mass617.27
IUPAC Name9-(2-dibenzofuran-2-ylphenyl)-3,6-bis(3,5-dimethylphenyl)carbazole
SMILESCc1cc(C)cc(-c2ccc3c(c2)c2cc(-c4cc(C)cc(C)c4)ccc2n3-c2ccccc2-c2ccc3oc4ccccc4c3c2)c1
InChIInChI=1S/C46H35NO/c1-28-19-29(2)22-35(21-28)32-13-16-43-39(25-32)40-26-33(36-23-30(3)20-31(4)24-36)14-17-44(40)47(43)42-11-7-5-9-37(42)34-15-18-46-41(27-34)38-10-6-8-12-45(38)48-46/h5-27H,1-4H3
InChIKeyJSRIDYXHPQKIDS-UHFFFAOYSA-N
XLogP12.92
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500617.79
LogP ≤ 512.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,6-di(dibenzofuran-2-yl)-9-[2-[4-(9-phenylcarbazol-4-yl)phenyl]phenyl]carbazole
CID 166037350
9-[2-(3-dibenzofuran-1-ylphenyl)phenyl]-3,6-diphenylcarbazole
CID 166037435
3-[9-(2-dibenzofuran-3-ylphenyl)carbazol-2-yl]-9-phenylcarbazole
CID 126753408
9-[2-[4-(4-dibenzofuran-2-ylphenyl)phenyl]phenyl]-2,7-diphenylcarbazole
CID 163423190
9-[4-dibenzofuran-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-bis(3,5-dimethylphenyl)carbazole
CID 155628013
3-(2-dibenzofuran-2-ylphenyl)-9-phenylcarbazole
CID 139423478
9-[4-dibenzofuran-4-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-bis(3,5-dimethylphenyl)carbazole
CID 155233215
9-(9-dibenzofuran-2-yldibenzofuran-1-yl)carbazole
CID 170276500
3-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-[4-[4-(3,5-dimethylphenyl)phenyl]phenyl]carbazole
CID 134370621
9-[4-dibenzofuran-2-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-bis(3-methylphenyl)carbazole
CID 155232239
12-(2-dibenzofuran-2-ylphenyl)-[1]benzofuro[2,3-a]carbazole
CID 171612094
9-(8-dibenzofuran-2-yldibenzothiophen-4-yl)-3,6-dimethylcarbazole
CID 149098591

Frequently Asked Questions

What is the IUPAC name of 9-(2-dibenzofuran-2-ylphenyl)-3,6-bis(3,5-dimethylphenyl)carbazole?
The IUPAC name of 9-(2-dibenzofuran-2-ylphenyl)-3,6-bis(3,5-dimethylphenyl)carbazole (CID 169284782) is 9-(2-dibenzofuran-2-ylphenyl)-3,6-bis(3,5-dimethylphenyl)carbazole.
What is the SMILES notation for 9-(2-dibenzofuran-2-ylphenyl)-3,6-bis(3,5-dimethylphenyl)carbazole?
The canonical SMILES for 9-(2-dibenzofuran-2-ylphenyl)-3,6-bis(3,5-dimethylphenyl)carbazole is Cc1cc(C)cc(-c2ccc3c(c2)c2cc(-c4cc(C)cc(C)c4)ccc2n3-c2ccccc2-c2ccc3oc4ccccc4c3c2)c1.
What is the InChIKey of 9-(2-dibenzofuran-2-ylphenyl)-3,6-bis(3,5-dimethylphenyl)carbazole?
The InChIKey is JSRIDYXHPQKIDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H35NO/c1-28-19-29(2)22-35(21-28)32-13-16-43-39(25-32)40-26-33(36-23-30(3)20-31(4)24-36)14-17-44(40)47(43)42-11-7-5-9-37(42)34-15-18-46-41(27-34)38-10-6-8-12-45(38)48-46/h5-27H,1-4H3.
What are the key properties of 9-(2-dibenzofuran-2-ylphenyl)-3,6-bis(3,5-dimethylphenyl)carbazole?
9-(2-dibenzofuran-2-ylphenyl)-3,6-bis(3,5-dimethylphenyl)carbazole has a molecular weight of 617.79 g/mol, XLogP of 12.92, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2-dibenzofuran-2-ylphenyl)-3,6-bis(3,5-dimethylphenyl)carbazole is sourced from PubChem (CID 169284782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).