1-[4-(8-phenyldibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole

C56H37NO — CID 126620700

IUPAC1-[4-(8-phenyldibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole
SMILESc1ccc(-c2ccc(-c3ccc4c(c3)c(-c3ccc(-c5ccccc5)cc3)cn4-c3ccc(-c4ccc5oc6ccc(-c7ccccc7)cc6c5c4)cc3)cc2)cc1
InChIInChI=1S/C56H37NO/c1-4-10-38(11-5-1)41-16-18-43(19-17-41)46-26-31-54-50(34-46)53(45-22-20-42(21-23-45)39-12-6-2-7-13-39)37-57(54)49-29-24-44(25-30-49)48-28-33-56-52(36-48)51-35-47(27-32-55(51)58-56)40-14-8-3-9-15-40/h1-37H
InChIKeyOKQVRWLNIJOAEE-UHFFFAOYSA-N
MW739.92 g/mol
LogP15.53
Rot. Bonds7

About 1-[4-(8-phenyldibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole

1-[4-(8-phenyldibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole (PubChem CID 126620700) has the molecular formula C56H37NO and a molecular weight of 739.92 g/mol. Its IUPAC name is 1-[4-(8-phenyldibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole.

Molecular Properties

Compound Name1-[4-(8-phenyldibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole
PubChem CID126620700
Molecular FormulaC56H37NO
Molecular Weight739.92 g/mol
Exact Mass739.29
IUPAC Name1-[4-(8-phenyldibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole
SMILESc1ccc(-c2ccc(-c3ccc4c(c3)c(-c3ccc(-c5ccccc5)cc3)cn4-c3ccc(-c4ccc5oc6ccc(-c7ccccc7)cc6c5c4)cc3)cc2)cc1
InChIInChI=1S/C56H37NO/c1-4-10-38(11-5-1)41-16-18-43(19-17-41)46-26-31-54-50(34-46)53(45-22-20-42(21-23-45)39-12-6-2-7-13-39)37-57(54)49-29-24-44(25-30-49)48-28-33-56-52(36-48)51-35-47(27-32-55(51)58-56)40-14-8-3-9-15-40/h1-37H
InChIKeyOKQVRWLNIJOAEE-UHFFFAOYSA-N
XLogP15.53
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500739.92
LogP ≤ 515.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,5-diphenyl-1-[4-(6-phenyldibenzofuran-4-yl)phenyl]indole;3,5-diphenyl-1-[4-(8-phenyldibenzofuran-2-yl)phenyl]indole;1-[4-(6-phenyldibenzofuran-4-yl)phenyl]-3,5-bis(4-phenylphenyl)indole
CID 162223458
1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-bis[4-(4-phenylphenyl)phenyl]indole;1-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-diphenylindole
CID 158939023
1-(3,5-diphenylphenyl)-3,5-bis[4-(4-phenylphenyl)phenyl]indole
CID 126620681
3,5-bis(4-phenanthren-9-ylphenyl)-1-(4-phenylphenyl)indole
CID 126620677
3-[3-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]phenyl]-1,5-diphenylindole
CID 154596814
1-dibenzofuran-4-yl-3,5-bis(4-phenylphenyl)indole
CID 126620720
3-cyclohexa-2,4-dien-1-yl-5-phenyl-1-[4-(8-phenyldibenzofuran-2-yl)phenyl]indole
CID 126620697
9-[4-(8-phenyldibenzofuran-2-yl)phenyl]carbazole
CID 58536267
3,5-bis(3,5-diphenylphenyl)-1-[4-(3-methoxyphenyl)phenyl]indole
CID 126620590
3,9-diphenyl-6-[8-[3-(3-phenylphenyl)phenyl]dibenzofuran-2-yl]carbazole
CID 118438947
3,6-di(dibenzofuran-2-yl)-9-[4-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]carbazole
CID 118488387
1-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-3,5-diphenylindole
CID 140898660

Frequently Asked Questions

What is the IUPAC name of 1-[4-(8-phenyldibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole?
The IUPAC name of 1-[4-(8-phenyldibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole (CID 126620700) is 1-[4-(8-phenyldibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole.
What is the SMILES notation for 1-[4-(8-phenyldibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole?
The canonical SMILES for 1-[4-(8-phenyldibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole is c1ccc(-c2ccc(-c3ccc4c(c3)c(-c3ccc(-c5ccccc5)cc3)cn4-c3ccc(-c4ccc5oc6ccc(-c7ccccc7)cc6c5c4)cc3)cc2)cc1.
What is the InChIKey of 1-[4-(8-phenyldibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole?
The InChIKey is OKQVRWLNIJOAEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H37NO/c1-4-10-38(11-5-1)41-16-18-43(19-17-41)46-26-31-54-50(34-46)53(45-22-20-42(21-23-45)39-12-6-2-7-13-39)37-57(54)49-29-24-44(25-30-49)48-28-33-56-52(36-48)51-35-47(27-32-55(51)58-56)40-14-8-3-9-15-40/h1-37H.
What are the key properties of 1-[4-(8-phenyldibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole?
1-[4-(8-phenyldibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole has a molecular weight of 739.92 g/mol, XLogP of 15.53, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(8-phenyldibenzofuran-2-yl)phenyl]-3,5-bis(4-phenylphenyl)indole is sourced from PubChem (CID 126620700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).