9-(4-carbazol-9-yl-9-methyldibenzofuran-2-yl)-3-[4-(4-phenylphenyl)phenyl]carbazole

C55H36N2O — CID 155111405

IUPAC9-(4-carbazol-9-yl-9-methyldibenzofuran-2-yl)-3-[4-(4-phenylphenyl)phenyl]carbazole
SMILESCc1cccc2oc3c(-n4c5ccccc5c5ccccc54)cc(-n4c5ccccc5c5cc(-c6ccc(-c7ccc(-c8ccccc8)cc7)cc6)ccc54)cc3c12
InChIInChI=1S/C55H36N2O/c1-35-12-11-21-53-54(35)47-33-42(34-52(55(47)58-53)57-49-19-9-5-15-43(49)44-16-6-10-20-50(44)57)56-48-18-8-7-17-45(48)46-32-41(30-31-51(46)56)40-28-26-39(27-29-40)38-24-22-37(23-25-38)36-13-3-2-4-14-36/h2-34H,1H3
InChIKeyUZFGWCQZEKBMSZ-UHFFFAOYSA-N
MW740.91 g/mol
LogP15.09
Rot. Bonds5

About 9-(4-carbazol-9-yl-9-methyldibenzofuran-2-yl)-3-[4-(4-phenylphenyl)phenyl]carbazole

9-(4-carbazol-9-yl-9-methyldibenzofuran-2-yl)-3-[4-(4-phenylphenyl)phenyl]carbazole (PubChem CID 155111405) has the molecular formula C55H36N2O and a molecular weight of 740.91 g/mol. Its IUPAC name is 9-(4-carbazol-9-yl-9-methyldibenzofuran-2-yl)-3-[4-(4-phenylphenyl)phenyl]carbazole.

Molecular Properties

Compound Name9-(4-carbazol-9-yl-9-methyldibenzofuran-2-yl)-3-[4-(4-phenylphenyl)phenyl]carbazole
PubChem CID155111405
Molecular FormulaC55H36N2O
Molecular Weight740.91 g/mol
Exact Mass740.28
IUPAC Name9-(4-carbazol-9-yl-9-methyldibenzofuran-2-yl)-3-[4-(4-phenylphenyl)phenyl]carbazole
SMILESCc1cccc2oc3c(-n4c5ccccc5c5ccccc54)cc(-n4c5ccccc5c5cc(-c6ccc(-c7ccc(-c8ccccc8)cc7)cc6)ccc54)cc3c12
InChIInChI=1S/C55H36N2O/c1-35-12-11-21-53-54(35)47-33-42(34-52(55(47)58-53)57-49-19-9-5-15-43(49)44-16-6-10-20-50(44)57)56-48-18-8-7-17-45(48)46-32-41(30-31-51(46)56)40-28-26-39(27-29-40)38-24-22-37(23-25-38)36-13-3-2-4-14-36/h2-34H,1H3
InChIKeyUZFGWCQZEKBMSZ-UHFFFAOYSA-N
XLogP15.09
TPSA23.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500740.91
LogP ≤ 515.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-(9-methyl-4-phenyldibenzofuran-2-yl)carbazole
CID 167228990
9-(9-methyl-4-naphthalen-2-yldibenzofuran-2-yl)-2-phenylcarbazole
CID 167228801
3-[3-(4-carbazol-9-yldibenzofuran-2-yl)phenyl]-9-phenylcarbazole;ethane
CID 144723930
3-(9-dibenzofuran-4-ylcarbazol-3-yl)-9-(8-phenyldibenzofuran-2-yl)carbazole
CID 123500568
2-[9-(2-phenyldibenzofuran-4-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 167201110
2-(9-phenylcarbazol-3-yl)-9-(2-phenyldibenzofuran-4-yl)carbazole
CID 167200544
9-dibenzofuran-2-yl-3-[3-(3-phenylphenyl)phenyl]carbazole;3,6-diphenyl-9-[8-[3-(3-phenylphenyl)phenyl]dibenzofuran-4-yl]carbazole;3-[3-(3-phenylphenyl)phenyl]-9-[8-[3-[3-(3-phenylphenyl)phenyl]carbazol-9-yl]dibenzofuran-2-yl]carbazole
CID 158273380
6-(9-dibenzofuran-4-ylcarbazol-3-yl)-2,9-diphenylcarbazole
CID 170072505
9-[6,8-di(carbazol-9-yl)dibenzofuran-2-yl]-6-phenylcarbazole-3-carbonitrile
CID 134343534
3-(9-phenylcarbazol-3-yl)-9-(8-phenyldibenzofuran-1-yl)carbazole
CID 164821289
3-(6-carbazol-9-yl-8-phenyldibenzofuran-2-yl)-9-dibenzothiophen-4-ylcarbazole
CID 155379459
N-[4-[4-(9-dibenzofuran-4-ylcarbazol-3-yl)phenyl]phenyl]-N,4-diphenylaniline
CID 90207100

Frequently Asked Questions

What is the IUPAC name of 9-(4-carbazol-9-yl-9-methyldibenzofuran-2-yl)-3-[4-(4-phenylphenyl)phenyl]carbazole?
The IUPAC name of 9-(4-carbazol-9-yl-9-methyldibenzofuran-2-yl)-3-[4-(4-phenylphenyl)phenyl]carbazole (CID 155111405) is 9-(4-carbazol-9-yl-9-methyldibenzofuran-2-yl)-3-[4-(4-phenylphenyl)phenyl]carbazole.
What is the SMILES notation for 9-(4-carbazol-9-yl-9-methyldibenzofuran-2-yl)-3-[4-(4-phenylphenyl)phenyl]carbazole?
The canonical SMILES for 9-(4-carbazol-9-yl-9-methyldibenzofuran-2-yl)-3-[4-(4-phenylphenyl)phenyl]carbazole is Cc1cccc2oc3c(-n4c5ccccc5c5ccccc54)cc(-n4c5ccccc5c5cc(-c6ccc(-c7ccc(-c8ccccc8)cc7)cc6)ccc54)cc3c12.
What is the InChIKey of 9-(4-carbazol-9-yl-9-methyldibenzofuran-2-yl)-3-[4-(4-phenylphenyl)phenyl]carbazole?
The InChIKey is UZFGWCQZEKBMSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H36N2O/c1-35-12-11-21-53-54(35)47-33-42(34-52(55(47)58-53)57-49-19-9-5-15-43(49)44-16-6-10-20-50(44)57)56-48-18-8-7-17-45(48)46-32-41(30-31-51(46)56)40-28-26-39(27-29-40)38-24-22-37(23-25-38)36-13-3-2-4-14-36/h2-34H,1H3.
What are the key properties of 9-(4-carbazol-9-yl-9-methyldibenzofuran-2-yl)-3-[4-(4-phenylphenyl)phenyl]carbazole?
9-(4-carbazol-9-yl-9-methyldibenzofuran-2-yl)-3-[4-(4-phenylphenyl)phenyl]carbazole has a molecular weight of 740.91 g/mol, XLogP of 15.09, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-carbazol-9-yl-9-methyldibenzofuran-2-yl)-3-[4-(4-phenylphenyl)phenyl]carbazole is sourced from PubChem (CID 155111405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).