4-[8-(4-cyclohexa-1,5-dien-1-ylnaphthalen-1-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;2,6-diphenyl-4-[8-(6-phenylnaphthalen-2-yl)dibenzofuran-1-yl]pyridine;4-[8-(6-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;4-[8-(4-naphthalen-2-ylphenyl)dibenzofuran-1-yl]-2,6-diphenylpyridine

C184H120N4O4 — CID 162125811

IUPAC4-[8-(4-cyclohexa-1,5-dien-1-ylnaphthalen-1-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;2,6-diphenyl-4-[8-(6-phenylnaphthalen-2-yl)dibenzofuran-1-yl]pyridine;4-[8-(6-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;4-[8-(4-naphthalen-2-ylphenyl)dibenzofuran-1-yl]-2,6-diphenylpyridine
SMILESC1=CC(c2ccc(-c3ccc4oc5cccc(-c6cc(-c7ccccc7)nc(-c7ccccc7)c6)c5c4c3)c3ccccc23)=CCC1.c1ccc(-c2cc(-c3cccc4oc5ccc(-c6ccc(-c7ccc8ccccc8c7)cc6)cc5c34)cc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3cccc4oc5ccc(-c6ccc7cc(-c8ccc9ccccc9c8)ccc7c6)cc5c34)cc(-c3ccccc3)n2)cc1.c1ccc(-c2ccc3cc(-c4ccc5oc6cccc(-c7cc(-c8ccccc8)nc(-c8ccccc8)c7)c6c5c4)ccc3c2)cc1
InChIInChI=1S/C49H31NO.C45H31NO.2C45H29NO/c1-3-11-33(12-4-1)45-30-42(31-46(50-45)34-13-5-2-6-14-34)43-16-9-17-48-49(43)44-29-41(24-25-47(44)51-48)40-23-22-38-27-37(20-21-39(38)28-40)36-19-18-32-10-7-8-15-35(32)26-36;1-4-13-30(14-5-1)35-24-25-36(39-20-11-10-19-38(35)39)33-23-26-43-40(27-33)45-37(21-12-22-44(45)47-43)34-28-41(31-15-6-2-7-16-31)46-42(29-34)32-17-8-3-9-18-32;1-4-11-30(12-5-1)33-19-20-35-26-36(22-21-34(35)25-33)37-23-24-43-40(27-37)45-39(17-10-18-44(45)47-43)38-28-41(31-13-6-2-7-14-31)46-42(29-38)32-15-8-3-9-16-32;1-3-11-33(12-4-1)41-28-38(29-42(46-41)34-13-5-2-6-14-34)39-16-9-17-44-45(39)40-27-37(24-25-43(40)47-44)32-20-18-31(19-21-32)36-23-22-30-10-7-8-15-35(30)26-36/h1-31H;2-4,6-29H,1,5H2;2*1-29H
InChIKeyZHZXORQSEJBTRH-UHFFFAOYSA-N
MW2451.01 g/mol
LogP51.10
Rot. Bonds20

About 4-[8-(4-cyclohexa-1,5-dien-1-ylnaphthalen-1-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;2,6-diphenyl-4-[8-(6-phenylnaphthalen-2-yl)dibenzofuran-1-yl]pyridine;4-[8-(6-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;4-[8-(4-naphthalen-2-ylphenyl)dibenzofuran-1-yl]-2,6-diphenylpyridine

4-[8-(4-cyclohexa-1,5-dien-1-ylnaphthalen-1-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;2,6-diphenyl-4-[8-(6-phenylnaphthalen-2-yl)dibenzofuran-1-yl]pyridine;4-[8-(6-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;4-[8-(4-naphthalen-2-ylphenyl)dibenzofuran-1-yl]-2,6-diphenylpyridine (PubChem CID 162125811) has the molecular formula C184H120N4O4 and a molecular weight of 2451.01 g/mol. Its IUPAC name is 4-[8-(4-cyclohexa-1,5-dien-1-ylnaphthalen-1-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;2,6-diphenyl-4-[8-(6-phenylnaphthalen-2-yl)dibenzofuran-1-yl]pyridine;4-[8-(6-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;4-[8-(4-naphthalen-2-ylphenyl)dibenzofuran-1-yl]-2,6-diphenylpyridine.

Molecular Properties

Compound Name4-[8-(4-cyclohexa-1,5-dien-1-ylnaphthalen-1-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;2,6-diphenyl-4-[8-(6-phenylnaphthalen-2-yl)dibenzofuran-1-yl]pyridine;4-[8-(6-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;4-[8-(4-naphthalen-2-ylphenyl)dibenzofuran-1-yl]-2,6-diphenylpyridine
PubChem CID162125811
Molecular FormulaC184H120N4O4
Molecular Weight2451.01 g/mol
Exact Mass2448.93
IUPAC Name4-[8-(4-cyclohexa-1,5-dien-1-ylnaphthalen-1-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;2,6-diphenyl-4-[8-(6-phenylnaphthalen-2-yl)dibenzofuran-1-yl]pyridine;4-[8-(6-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;4-[8-(4-naphthalen-2-ylphenyl)dibenzofuran-1-yl]-2,6-diphenylpyridine
SMILESC1=CC(c2ccc(-c3ccc4oc5cccc(-c6cc(-c7ccccc7)nc(-c7ccccc7)c6)c5c4c3)c3ccccc23)=CCC1.c1ccc(-c2cc(-c3cccc4oc5ccc(-c6ccc(-c7ccc8ccccc8c7)cc6)cc5c34)cc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3cccc4oc5ccc(-c6ccc7cc(-c8ccc9ccccc9c8)ccc7c6)cc5c34)cc(-c3ccccc3)n2)cc1.c1ccc(-c2ccc3cc(-c4ccc5oc6cccc(-c7cc(-c8ccccc8)nc(-c8ccccc8)c7)c6c5c4)ccc3c2)cc1
InChIInChI=1S/C49H31NO.C45H31NO.2C45H29NO/c1-3-11-33(12-4-1)45-30-42(31-46(50-45)34-13-5-2-6-14-34)43-16-9-17-48-49(43)44-29-41(24-25-47(44)51-48)40-23-22-38-27-37(20-21-39(38)28-40)36-19-18-32-10-7-8-15-35(32)26-36;1-4-13-30(14-5-1)35-24-25-36(39-20-11-10-19-38(35)39)33-23-26-43-40(27-33)45-37(21-12-22-44(45)47-43)34-28-41(31-15-6-2-7-16-31)46-42(29-34)32-17-8-3-9-18-32;1-4-11-30(12-5-1)33-19-20-35-26-36(22-21-34(35)25-33)37-23-24-43-40(27-37)45-39(17-10-18-44(45)47-43)38-28-41(31-13-6-2-7-14-31)46-42(29-38)32-15-8-3-9-16-32;1-3-11-33(12-4-1)41-28-38(29-42(46-41)34-13-5-2-6-14-34)39-16-9-17-44-45(39)40-27-37(24-25-43(40)47-44)32-20-18-31(19-21-32)36-23-22-30-10-7-8-15-35(30)26-36/h1-31H;2-4,6-29H,1,5H2;2*1-29H
InChIKeyZHZXORQSEJBTRH-UHFFFAOYSA-N
XLogP51.10
TPSA104.12 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds20
Heavy Atoms192
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002451.01
LogP ≤ 551.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 4-[8-(4-cyclohexa-1,5-dien-1-ylnaphthalen-1-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;2,6-diphenyl-4-[8-(6-phenylnaphthalen-2-yl)dibenzofuran-1-yl]pyridine;4-[8-(6-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;4-[8-(4-naphthalen-2-ylphenyl)dibenzofuran-1-yl]-2,6-diphenylpyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[8-(4-cyclohexa-1,5-dien-1-ylnaphthalen-1-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;2,6-diphenyl-4-[8-(6-phenylnaphthalen-2-yl)dibenzofuran-1-yl]pyridine;4-[8-(6-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;4-[8-(4-naphthalen-2-ylphenyl)dibenzofuran-1-yl]-2,6-diphenylpyridine?
The IUPAC name of 4-[8-(4-cyclohexa-1,5-dien-1-ylnaphthalen-1-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;2,6-diphenyl-4-[8-(6-phenylnaphthalen-2-yl)dibenzofuran-1-yl]pyridine;4-[8-(6-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;4-[8-(4-naphthalen-2-ylphenyl)dibenzofuran-1-yl]-2,6-diphenylpyridine (CID 162125811) is 4-[8-(4-cyclohexa-1,5-dien-1-ylnaphthalen-1-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;2,6-diphenyl-4-[8-(6-phenylnaphthalen-2-yl)dibenzofuran-1-yl]pyridine;4-[8-(6-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;4-[8-(4-naphthalen-2-ylphenyl)dibenzofuran-1-yl]-2,6-diphenylpyridine.
What is the SMILES notation for 4-[8-(4-cyclohexa-1,5-dien-1-ylnaphthalen-1-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;2,6-diphenyl-4-[8-(6-phenylnaphthalen-2-yl)dibenzofuran-1-yl]pyridine;4-[8-(6-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;4-[8-(4-naphthalen-2-ylphenyl)dibenzofuran-1-yl]-2,6-diphenylpyridine?
The canonical SMILES for 4-[8-(4-cyclohexa-1,5-dien-1-ylnaphthalen-1-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;2,6-diphenyl-4-[8-(6-phenylnaphthalen-2-yl)dibenzofuran-1-yl]pyridine;4-[8-(6-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;4-[8-(4-naphthalen-2-ylphenyl)dibenzofuran-1-yl]-2,6-diphenylpyridine is C1=CC(c2ccc(-c3ccc4oc5cccc(-c6cc(-c7ccccc7)nc(-c7ccccc7)c6)c5c4c3)c3ccccc23)=CCC1.c1ccc(-c2cc(-c3cccc4oc5ccc(-c6ccc(-c7ccc8ccccc8c7)cc6)cc5c34)cc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3cccc4oc5ccc(-c6ccc7cc(-c8ccc9ccccc9c8)ccc7c6)cc5c34)cc(-c3ccccc3)n2)cc1.c1ccc(-c2ccc3cc(-c4ccc5oc6cccc(-c7cc(-c8ccccc8)nc(-c8ccccc8)c7)c6c5c4)ccc3c2)cc1.
What is the InChIKey of 4-[8-(4-cyclohexa-1,5-dien-1-ylnaphthalen-1-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;2,6-diphenyl-4-[8-(6-phenylnaphthalen-2-yl)dibenzofuran-1-yl]pyridine;4-[8-(6-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;4-[8-(4-naphthalen-2-ylphenyl)dibenzofuran-1-yl]-2,6-diphenylpyridine?
The InChIKey is ZHZXORQSEJBTRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H31NO.C45H31NO.2C45H29NO/c1-3-11-33(12-4-1)45-30-42(31-46(50-45)34-13-5-2-6-14-34)43-16-9-17-48-49(43)44-29-41(24-25-47(44)51-48)40-23-22-38-27-37(20-21-39(38)28-40)36-19-18-32-10-7-8-15-35(32)26-36;1-4-13-30(14-5-1)35-24-25-36(39-20-11-10-19-38(35)39)33-23-26-43-40(27-33)45-37(21-12-22-44(45)47-43)34-28-41(31-15-6-2-7-16-31)46-42(29-34)32-17-8-3-9-18-32;1-4-11-30(12-5-1)33-19-20-35-26-36(22-21-34(35)25-33)37-23-24-43-40(27-37)45-39(17-10-18-44(45)47-43)38-28-41(31-13-6-2-7-14-31)46-42(29-38)32-15-8-3-9-16-32;1-3-11-33(12-4-1)41-28-38(29-42(46-41)34-13-5-2-6-14-34)39-16-9-17-44-45(39)40-27-37(24-25-43(40)47-44)32-20-18-31(19-21-32)36-23-22-30-10-7-8-15-35(30)26-36/h1-31H;2-4,6-29H,1,5H2;2*1-29H.
What are the key properties of 4-[8-(4-cyclohexa-1,5-dien-1-ylnaphthalen-1-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;2,6-diphenyl-4-[8-(6-phenylnaphthalen-2-yl)dibenzofuran-1-yl]pyridine;4-[8-(6-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;4-[8-(4-naphthalen-2-ylphenyl)dibenzofuran-1-yl]-2,6-diphenylpyridine?
4-[8-(4-cyclohexa-1,5-dien-1-ylnaphthalen-1-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;2,6-diphenyl-4-[8-(6-phenylnaphthalen-2-yl)dibenzofuran-1-yl]pyridine;4-[8-(6-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;4-[8-(4-naphthalen-2-ylphenyl)dibenzofuran-1-yl]-2,6-diphenylpyridine has a molecular weight of 2451.01 g/mol, XLogP of 51.10, 20 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[8-(4-cyclohexa-1,5-dien-1-ylnaphthalen-1-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;2,6-diphenyl-4-[8-(6-phenylnaphthalen-2-yl)dibenzofuran-1-yl]pyridine;4-[8-(6-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-yl]-2,6-diphenylpyridine;4-[8-(4-naphthalen-2-ylphenyl)dibenzofuran-1-yl]-2,6-diphenylpyridine is sourced from PubChem (CID 162125811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).