12-phenyl-7-[6-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]-7H-indeno[1,2-a]carbazole

C55H35NO — CID 118349912

IUPAC12-phenyl-7-[6-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]-7H-indeno[1,2-a]carbazole
SMILESc1ccc(-c2ccc(-c3cccc(-c4cccc5c4oc4c(C6c7ccccc7-c7c6ccc6c8ccccc8n(-c8ccccc8)c76)cccc45)c3)cc2)cc1
InChIInChI=1S/C55H35NO/c1-3-14-35(15-4-1)36-28-30-37(31-29-36)38-16-11-17-39(34-38)41-23-12-24-46-47-25-13-26-49(55(47)57-54(41)46)51-43-21-7-8-22-44(43)52-48(51)33-32-45-42-20-9-10-27-50(42)56(53(45)52)40-18-5-2-6-19-40/h1-34,51H
InChIKeySZPWISLAWVHYIG-UHFFFAOYSA-N
MW725.89 g/mol
LogP14.84
Rot. Bonds5

About 12-phenyl-7-[6-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]-7H-indeno[1,2-a]carbazole

12-phenyl-7-[6-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]-7H-indeno[1,2-a]carbazole (PubChem CID 118349912) has the molecular formula C55H35NO and a molecular weight of 725.89 g/mol. Its IUPAC name is 12-phenyl-7-[6-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]-7H-indeno[1,2-a]carbazole.

Molecular Properties

Compound Name12-phenyl-7-[6-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]-7H-indeno[1,2-a]carbazole
PubChem CID118349912
Molecular FormulaC55H35NO
Molecular Weight725.89 g/mol
Exact Mass725.27
IUPAC Name12-phenyl-7-[6-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]-7H-indeno[1,2-a]carbazole
SMILESc1ccc(-c2ccc(-c3cccc(-c4cccc5c4oc4c(C6c7ccccc7-c7c6ccc6c8ccccc8n(-c8ccccc8)c76)cccc45)c3)cc2)cc1
InChIInChI=1S/C55H35NO/c1-3-14-35(15-4-1)36-28-30-37(31-29-36)38-16-11-17-39(34-38)41-23-12-24-46-47-25-13-26-49(55(47)57-54(41)46)51-43-21-7-8-22-44(43)52-48(51)33-32-45-42-20-9-10-27-50(42)56(53(45)52)40-18-5-2-6-19-40/h1-34,51H
InChIKeySZPWISLAWVHYIG-UHFFFAOYSA-N
XLogP14.84
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500725.89
LogP ≤ 514.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[9-[6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-4-yl]-9H-fluoren-3-yl]-9-phenylcarbazole
CID 144782080
10-phenyl-6-(7-phenyldibenzothiophen-3-yl)-[1]benzofuro[3,2-b]indole
CID 164827967
9-phenyl-3-[3-(6-phenyldibenzofuran-4-yl)-5-(3-phenylphenyl)phenyl]carbazole;9-phenyl-3-[3-(6-phenyldibenzofuran-4-yl)-5-(4-phenylphenyl)phenyl]carbazole
CID 159217991
12-(4-dibenzofuran-4-ylphenyl)-2,11-diphenylindolo[2,3-a]carbazole
CID 126580151
9-phenyl-1-(3-triphenylen-2-ylphenyl)carbazole
CID 118014216
12-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-11-phenylindolo[2,3-a]carbazole
CID 90191508
6-(3-dibenzofuran-4-ylphenyl)-10-phenyl-[1]benzofuro[3,2-b]indole
CID 164828171
9-phenyl-1-[2-(3-phenylphenyl)phenyl]carbazole
CID 175012916
9-phenyl-1-[3-[3-phenyl-5-(9-phenylcarbazol-1-yl)phenyl]phenyl]carbazole
CID 71127197
2-[3-dibenzofuran-4-yl-5-(3-phenylphenyl)phenyl]-9-phenylcarbazole
CID 122492294
2-[9-[3-(3-dibenzofuran-4-ylphenyl)phenyl]carbazol-2-yl]-9-phenylcarbazole
CID 166509994
10-phenyl-6-[2-(7-phenyldibenzothiophen-3-yl)phenyl]-[1]benzofuro[3,2-b]indole
CID 164828184

Frequently Asked Questions

What is the IUPAC name of 12-phenyl-7-[6-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]-7H-indeno[1,2-a]carbazole?
The IUPAC name of 12-phenyl-7-[6-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]-7H-indeno[1,2-a]carbazole (CID 118349912) is 12-phenyl-7-[6-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]-7H-indeno[1,2-a]carbazole.
What is the SMILES notation for 12-phenyl-7-[6-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]-7H-indeno[1,2-a]carbazole?
The canonical SMILES for 12-phenyl-7-[6-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]-7H-indeno[1,2-a]carbazole is c1ccc(-c2ccc(-c3cccc(-c4cccc5c4oc4c(C6c7ccccc7-c7c6ccc6c8ccccc8n(-c8ccccc8)c76)cccc45)c3)cc2)cc1.
What is the InChIKey of 12-phenyl-7-[6-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]-7H-indeno[1,2-a]carbazole?
The InChIKey is SZPWISLAWVHYIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H35NO/c1-3-14-35(15-4-1)36-28-30-37(31-29-36)38-16-11-17-39(34-38)41-23-12-24-46-47-25-13-26-49(55(47)57-54(41)46)51-43-21-7-8-22-44(43)52-48(51)33-32-45-42-20-9-10-27-50(42)56(53(45)52)40-18-5-2-6-19-40/h1-34,51H.
What are the key properties of 12-phenyl-7-[6-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]-7H-indeno[1,2-a]carbazole?
12-phenyl-7-[6-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]-7H-indeno[1,2-a]carbazole has a molecular weight of 725.89 g/mol, XLogP of 14.84, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 12-phenyl-7-[6-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-yl]-7H-indeno[1,2-a]carbazole is sourced from PubChem (CID 118349912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).