4,8-bis(4-naphthalen-1-ylphenyl)-2,3,6,7-tetraphenylfuro[2,3-f][1]benzofuran

C66H42O2 — CID 58160893

IUPAC4,8-bis(4-naphthalen-1-ylphenyl)-2,3,6,7-tetraphenylfuro[2,3-f][1]benzofuran
SMILESc1ccc(-c2oc3c(-c4ccc(-c5cccc6ccccc56)cc4)c4c(-c5ccccc5)c(-c5ccccc5)oc4c(-c4ccc(-c5cccc6ccccc56)cc4)c3c2-c2ccccc2)cc1
InChIInChI=1S/C66H42O2/c1-5-21-47(22-6-1)57-61-59(49-39-35-45(36-40-49)55-33-17-29-43-19-13-15-31-53(43)55)66-62(58(48-23-7-2-8-24-48)64(68-66)52-27-11-4-12-28-52)60(65(61)67-63(57)51-25-9-3-10-26-51)50-41-37-46(38-42-50)56-34-18-30-44-20-14-16-32-54(44)56/h1-42H
InChIKeyLZWWNSMZUUIQQE-UHFFFAOYSA-N
MW867.06 g/mol
LogP18.82
Rot. Bonds8

About 4,8-bis(4-naphthalen-1-ylphenyl)-2,3,6,7-tetraphenylfuro[2,3-f][1]benzofuran

4,8-bis(4-naphthalen-1-ylphenyl)-2,3,6,7-tetraphenylfuro[2,3-f][1]benzofuran (PubChem CID 58160893) has the molecular formula C66H42O2 and a molecular weight of 867.06 g/mol. Its IUPAC name is 4,8-bis(4-naphthalen-1-ylphenyl)-2,3,6,7-tetraphenylfuro[2,3-f][1]benzofuran.

Molecular Properties

Compound Name4,8-bis(4-naphthalen-1-ylphenyl)-2,3,6,7-tetraphenylfuro[2,3-f][1]benzofuran
PubChem CID58160893
Molecular FormulaC66H42O2
Molecular Weight867.06 g/mol
Exact Mass866.32
IUPAC Name4,8-bis(4-naphthalen-1-ylphenyl)-2,3,6,7-tetraphenylfuro[2,3-f][1]benzofuran
SMILESc1ccc(-c2oc3c(-c4ccc(-c5cccc6ccccc56)cc4)c4c(-c5ccccc5)c(-c5ccccc5)oc4c(-c4ccc(-c5cccc6ccccc56)cc4)c3c2-c2ccccc2)cc1
InChIInChI=1S/C66H42O2/c1-5-21-47(22-6-1)57-61-59(49-39-35-45(36-40-49)55-33-17-29-43-19-13-15-31-53(43)55)66-62(58(48-23-7-2-8-24-48)64(68-66)52-27-11-4-12-28-52)60(65(61)67-63(57)51-25-9-3-10-26-51)50-41-37-46(38-42-50)56-34-18-30-44-20-14-16-32-54(44)56/h1-42H
InChIKeyLZWWNSMZUUIQQE-UHFFFAOYSA-N
XLogP18.82
TPSA26.28 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms68
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500867.06
LogP ≤ 518.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4,8-bis(4-naphthalen-1-ylphenyl)-2,3,6,7-tetraphenylfuro[2,3-f][1]benzofuran with MolForge

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Related Compounds

5-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-1,2,4-triphenylbenzo[e][1]benzofuran
CID 58340453
9-(4-naphthalen-1-ylphenyl)-4-(4-naphthalen-2-ylphenyl)-1,2,6,7-tetraphenyl-[1]benzofuro[7,6-g][1]benzofuran
CID 58151120
N-[4-(2,3-diphenylphenanthro[10,9-b]furan-10-yl)phenyl]-N-(4-naphthalen-1-ylphenyl)phenanthren-9-amine
CID 155105614
1-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]-6-phenyldibenzofuran
CID 176751774
9-(4-naphthalen-1-ylphenyl)-10-[4-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]anthracene
CID 59557524
2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-3-phenyl-1-benzofuran
CID 121336223
9-(4-naphthalen-1-ylphenyl)-10-(8-phenylnaphthalen-1-yl)anthracene
CID 123676833
4,9-bis(4-naphthalen-1-ylphenyl)-1,2,6,7-tetraphenyl-[1]benzofuro[7,6-g][1]benzofuran;4-N,4-N,9-N,9-N,1,6-hexakis-phenyl-[1]benzofuro[7,6-g][1]benzofuran-4,9-diamine
CID 158363165
9-(4-naphthalen-1-ylphenyl)-10-[4-(3-phenylphenyl)phenyl]anthracene
CID 59398966
7-[10-(2,3-diphenyl-1-benzofuran-7-yl)anthracen-9-yl]-2,3-diphenyl-1-benzofuran
CID 58239715
2,4-diphenyl-5-[3-(10-phenylanthracen-9-yl)phenyl]-1-(4-phenylphenyl)benzo[e][1]benzofuran
CID 58340427
9,22-dinaphthalen-1-yl-5,18-diphenyl-16,30-dioxaoctacyclo[15.11.1.14,28.02,15.03,12.06,11.019,24.025,29]triaconta-1(28),2(15),3,5,7,9,11,13,17(29),18,20,22,24,26-tetradecaene
CID 59147732

Frequently Asked Questions

What is the IUPAC name of 4,8-bis(4-naphthalen-1-ylphenyl)-2,3,6,7-tetraphenylfuro[2,3-f][1]benzofuran?
The IUPAC name of 4,8-bis(4-naphthalen-1-ylphenyl)-2,3,6,7-tetraphenylfuro[2,3-f][1]benzofuran (CID 58160893) is 4,8-bis(4-naphthalen-1-ylphenyl)-2,3,6,7-tetraphenylfuro[2,3-f][1]benzofuran.
What is the SMILES notation for 4,8-bis(4-naphthalen-1-ylphenyl)-2,3,6,7-tetraphenylfuro[2,3-f][1]benzofuran?
The canonical SMILES for 4,8-bis(4-naphthalen-1-ylphenyl)-2,3,6,7-tetraphenylfuro[2,3-f][1]benzofuran is c1ccc(-c2oc3c(-c4ccc(-c5cccc6ccccc56)cc4)c4c(-c5ccccc5)c(-c5ccccc5)oc4c(-c4ccc(-c5cccc6ccccc56)cc4)c3c2-c2ccccc2)cc1.
What is the InChIKey of 4,8-bis(4-naphthalen-1-ylphenyl)-2,3,6,7-tetraphenylfuro[2,3-f][1]benzofuran?
The InChIKey is LZWWNSMZUUIQQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H42O2/c1-5-21-47(22-6-1)57-61-59(49-39-35-45(36-40-49)55-33-17-29-43-19-13-15-31-53(43)55)66-62(58(48-23-7-2-8-24-48)64(68-66)52-27-11-4-12-28-52)60(65(61)67-63(57)51-25-9-3-10-26-51)50-41-37-46(38-42-50)56-34-18-30-44-20-14-16-32-54(44)56/h1-42H.
What are the key properties of 4,8-bis(4-naphthalen-1-ylphenyl)-2,3,6,7-tetraphenylfuro[2,3-f][1]benzofuran?
4,8-bis(4-naphthalen-1-ylphenyl)-2,3,6,7-tetraphenylfuro[2,3-f][1]benzofuran has a molecular weight of 867.06 g/mol, XLogP of 18.82, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,8-bis(4-naphthalen-1-ylphenyl)-2,3,6,7-tetraphenylfuro[2,3-f][1]benzofuran is sourced from PubChem (CID 58160893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).