7-[10-(4-methylfuran-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylfuran-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(4-methylthiophen-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylthiophen-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran

C204H128O6S2 — CID 161334563

IUPAC7-[10-(4-methylfuran-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylfuran-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(4-methylthiophen-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylthiophen-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran
SMILESCc1ccc(-c2c3ccccc3c(-c3ccc4c(c3)oc3cccc(-c5c6ccccc6c(-c6ccccc6)c6ccccc56)c34)c3ccccc23)o1.Cc1ccc(-c2c3ccccc3c(-c3ccc4c(c3)oc3cccc(-c5c6ccccc6c(-c6ccccc6)c6ccccc56)c34)c3ccccc23)s1.Cc1cocc1-c1c2ccccc2c(-c2ccc3c(c2)oc2cccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c23)c2ccccc12.Cc1cscc1-c1c2ccccc2c(-c2ccc3c(c2)oc2cccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c23)c2ccccc12
InChIInChI=1S/2C51H32O2.2C51H32OS/c1-31-26-29-45(52-31)50-40-22-11-7-18-36(40)48(37-19-8-12-23-41(37)50)33-27-28-42-46(30-33)53-44-25-13-24-43(51(42)44)49-38-20-9-5-16-34(38)47(32-14-3-2-4-15-32)35-17-6-10-21-39(35)49;1-31-29-52-30-44(31)50-40-22-11-7-18-36(40)48(37-19-8-12-23-41(37)50)33-26-27-42-46(28-33)53-45-25-13-24-43(51(42)45)49-38-20-9-5-16-34(38)47(32-14-3-2-4-15-32)35-17-6-10-21-39(35)49;1-31-26-29-46(53-31)51-40-22-11-7-18-36(40)48(37-19-8-12-23-41(37)51)33-27-28-42-45(30-33)52-44-25-13-24-43(50(42)44)49-38-20-9-5-16-34(38)47(32-14-3-2-4-15-32)35-17-6-10-21-39(35)49;1-31-29-53-30-44(31)50-40-22-11-7-18-36(40)48(37-19-8-12-23-41(37)50)33-26-27-42-46(28-33)52-45-25-13-24-43(51(42)45)49-38-20-9-5-16-34(38)47(32-14-3-2-4-15-32)35-17-6-10-21-39(35)49/h4*2-30H,1H3
InChIKeyVLVXHFPXLXBVMK-UHFFFAOYSA-N
MW2739.40 g/mol
LogP60.01
Rot. Bonds16

About 7-[10-(4-methylfuran-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylfuran-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(4-methylthiophen-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylthiophen-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran

7-[10-(4-methylfuran-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylfuran-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(4-methylthiophen-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylthiophen-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran (PubChem CID 161334563) has the molecular formula C204H128O6S2 and a molecular weight of 2739.40 g/mol. Its IUPAC name is 7-[10-(4-methylfuran-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylfuran-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(4-methylthiophen-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylthiophen-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran.

Molecular Properties

Compound Name7-[10-(4-methylfuran-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylfuran-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(4-methylthiophen-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylthiophen-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran
PubChem CID161334563
Molecular FormulaC204H128O6S2
Molecular Weight2739.40 g/mol
Exact Mass2736.92
IUPAC Name7-[10-(4-methylfuran-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylfuran-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(4-methylthiophen-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylthiophen-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran
SMILESCc1ccc(-c2c3ccccc3c(-c3ccc4c(c3)oc3cccc(-c5c6ccccc6c(-c6ccccc6)c6ccccc56)c34)c3ccccc23)o1.Cc1ccc(-c2c3ccccc3c(-c3ccc4c(c3)oc3cccc(-c5c6ccccc6c(-c6ccccc6)c6ccccc56)c34)c3ccccc23)s1.Cc1cocc1-c1c2ccccc2c(-c2ccc3c(c2)oc2cccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c23)c2ccccc12.Cc1cscc1-c1c2ccccc2c(-c2ccc3c(c2)oc2cccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c23)c2ccccc12
InChIInChI=1S/2C51H32O2.2C51H32OS/c1-31-26-29-45(52-31)50-40-22-11-7-18-36(40)48(37-19-8-12-23-41(37)50)33-27-28-42-46(30-33)53-44-25-13-24-43(51(42)44)49-38-20-9-5-16-34(38)47(32-14-3-2-4-15-32)35-17-6-10-21-39(35)49;1-31-29-52-30-44(31)50-40-22-11-7-18-36(40)48(37-19-8-12-23-41(37)50)33-26-27-42-46(28-33)53-45-25-13-24-43(51(42)45)49-38-20-9-5-16-34(38)47(32-14-3-2-4-15-32)35-17-6-10-21-39(35)49;1-31-26-29-46(53-31)51-40-22-11-7-18-36(40)48(37-19-8-12-23-41(37)51)33-27-28-42-45(30-33)52-44-25-13-24-43(50(42)44)49-38-20-9-5-16-34(38)47(32-14-3-2-4-15-32)35-17-6-10-21-39(35)49;1-31-29-53-30-44(31)50-40-22-11-7-18-36(40)48(37-19-8-12-23-41(37)50)33-26-27-42-46(28-33)52-45-25-13-24-43(51(42)45)49-38-20-9-5-16-34(38)47(32-14-3-2-4-15-32)35-17-6-10-21-39(35)49/h4*2-30H,1H3
InChIKeyVLVXHFPXLXBVMK-UHFFFAOYSA-N
XLogP60.01
TPSA78.84 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds16
Heavy Atoms212
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002739.40
LogP ≤ 560.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 7-[10-(4-methylfuran-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylfuran-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(4-methylthiophen-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylthiophen-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran with MolForge

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Related Compounds

2-methyl-5-[10-[7-(10-phenylanthracen-9-yl)dibenzoselenophen-4-yl]anthracen-9-yl]furan;3-methyl-4-[10-[7-(10-phenylanthracen-9-yl)dibenzoselenophen-4-yl]anthracen-9-yl]furan;2-methyl-5-[10-[7-(10-phenylanthracen-9-yl)dibenzoselenophen-4-yl]anthracen-9-yl]thiophene
CID 161186014
1,6-bis(10-naphthalen-1-ylanthracen-9-yl)dibenzofuran;1,6-bis(10-naphthalen-2-ylanthracen-9-yl)dibenzofuran;1,6-bis(10-phenylanthracen-9-yl)dibenzofuran;6-[10-(4-methylfuran-3-yl)anthracen-9-yl]-2-(10-phenylanthracen-9-yl)dibenzofuran;6-[10-(4-methylthiophen-3-yl)anthracen-9-yl]-2-(10-phenylanthracen-9-yl)dibenzofuran
CID 158533281
1-(10-phenylanthracen-9-yl)-7-(3-phenylphenyl)dibenzofuran
CID 134471934
1-phenyl-7-[10-(3-phenylphenyl)anthracen-9-yl]dibenzofuran
CID 174167645
2-methyl-5-[10-[8-(10-phenylanthracen-9-yl)dibenzoselenophen-4-yl]anthracen-9-yl]furan
CID 161168081
2-methyl-5-[10-[7-[10-(5-methylfuran-2-yl)anthracen-9-yl]dibenzoselenophen-1-yl]anthracen-9-yl]furan
CID 161037729
7-[9-(10-phenylanthracen-9-yl)dibenzofuran-3-yl]naphtho[1,2-b][1]benzofuran
CID 170249935
2-methyl-5-[10-[9-(10-phenylanthracen-9-yl)dibenzoselenophen-4-yl]anthracen-9-yl]furan
CID 159746388
1-[10-[7-[7-(10-phenylanthracen-9-yl)naphthalen-2-yl]naphthalen-2-yl]anthracen-9-yl]dibenzofuran
CID 170448220
7-(9,9-dimethylfluoren-3-yl)-1-(10-phenylanthracen-9-yl)dibenzofuran
CID 170249943
1-(10-dibenzofuran-1-yl-2,7-diphenylanthracen-9-yl)dibenzofuran
CID 168795804
2-dibenzofuran-3-yl-1-[5-(10-phenylanthracen-9-yl)naphthalen-1-yl]dibenzofuran
CID 134164786

Frequently Asked Questions

What is the IUPAC name of 7-[10-(4-methylfuran-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylfuran-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(4-methylthiophen-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylthiophen-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran?
The IUPAC name of 7-[10-(4-methylfuran-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylfuran-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(4-methylthiophen-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylthiophen-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran (CID 161334563) is 7-[10-(4-methylfuran-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylfuran-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(4-methylthiophen-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylthiophen-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran.
What is the SMILES notation for 7-[10-(4-methylfuran-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylfuran-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(4-methylthiophen-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylthiophen-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran?
The canonical SMILES for 7-[10-(4-methylfuran-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylfuran-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(4-methylthiophen-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylthiophen-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran is Cc1ccc(-c2c3ccccc3c(-c3ccc4c(c3)oc3cccc(-c5c6ccccc6c(-c6ccccc6)c6ccccc56)c34)c3ccccc23)o1.Cc1ccc(-c2c3ccccc3c(-c3ccc4c(c3)oc3cccc(-c5c6ccccc6c(-c6ccccc6)c6ccccc56)c34)c3ccccc23)s1.Cc1cocc1-c1c2ccccc2c(-c2ccc3c(c2)oc2cccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c23)c2ccccc12.Cc1cscc1-c1c2ccccc2c(-c2ccc3c(c2)oc2cccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c23)c2ccccc12.
What is the InChIKey of 7-[10-(4-methylfuran-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylfuran-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(4-methylthiophen-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylthiophen-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran?
The InChIKey is VLVXHFPXLXBVMK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C51H32O2.2C51H32OS/c1-31-26-29-45(52-31)50-40-22-11-7-18-36(40)48(37-19-8-12-23-41(37)50)33-27-28-42-46(30-33)53-44-25-13-24-43(51(42)44)49-38-20-9-5-16-34(38)47(32-14-3-2-4-15-32)35-17-6-10-21-39(35)49;1-31-29-52-30-44(31)50-40-22-11-7-18-36(40)48(37-19-8-12-23-41(37)50)33-26-27-42-46(28-33)53-45-25-13-24-43(51(42)45)49-38-20-9-5-16-34(38)47(32-14-3-2-4-15-32)35-17-6-10-21-39(35)49;1-31-26-29-46(53-31)51-40-22-11-7-18-36(40)48(37-19-8-12-23-41(37)51)33-27-28-42-45(30-33)52-44-25-13-24-43(50(42)44)49-38-20-9-5-16-34(38)47(32-14-3-2-4-15-32)35-17-6-10-21-39(35)49;1-31-29-53-30-44(31)50-40-22-11-7-18-36(40)48(37-19-8-12-23-41(37)50)33-26-27-42-46(28-33)52-45-25-13-24-43(51(42)45)49-38-20-9-5-16-34(38)47(32-14-3-2-4-15-32)35-17-6-10-21-39(35)49/h4*2-30H,1H3.
What are the key properties of 7-[10-(4-methylfuran-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylfuran-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(4-methylthiophen-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylthiophen-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran?
7-[10-(4-methylfuran-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylfuran-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(4-methylthiophen-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylthiophen-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran has a molecular weight of 2739.40 g/mol, XLogP of 60.01, 16 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[10-(4-methylfuran-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylfuran-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(4-methylthiophen-3-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran;7-[10-(5-methylthiophen-2-yl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran is sourced from PubChem (CID 161334563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).