2,4-di(dibenzofuran-1-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-2-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-4-yl)-6-(3-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)-1,3,5-triazine

C165H113N9O6 — CID 158143524

IUPAC2,4-di(dibenzofuran-1-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-2-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-4-yl)-6-(3-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)-1,3,5-triazine
SMILESc1cc(-c2nc(-c3cccc4c3oc3ccccc34)nc(-c3cccc4c3oc3ccccc34)n2)cc(-c2cccc3c2-c2ccccc2C32CCCCC2)c1.c1ccc2c(c1)-c1c(-c3ccc(-c4ccc(-c5nc(-c6ccc7oc8ccccc8c7c6)nc(-c6ccc7oc8ccccc8c7c6)n5)cc4)cc3)cccc1C21CCCCC1.c1ccc2c(c1)-c1c(-c3ccc(-c4ccc(-c5nc(-c6cccc7oc8ccccc8c67)nc(-c6cccc7oc8ccccc8c67)n5)cc4)cc3)cccc1C21CCCCC1
InChIInChI=1S/2C57H39N3O2.C51H35N3O2/c1-8-33-57(34-9-1)45-19-5-2-13-40(45)51-39(16-10-20-46(51)57)37-29-25-35(26-30-37)36-27-31-38(32-28-36)54-58-55(43-17-11-23-49-52(43)41-14-3-6-21-47(41)61-49)60-56(59-54)44-18-12-24-50-53(44)42-15-4-7-22-48(42)62-50;1-8-31-57(32-9-1)47-15-5-2-13-44(47)53-41(14-10-16-48(53)57)37-23-19-35(20-24-37)36-21-25-38(26-22-36)54-58-55(39-27-29-51-45(33-39)42-11-3-6-17-49(42)61-51)60-56(59-54)40-28-30-52-46(34-40)43-12-4-7-18-50(43)62-52;1-8-28-51(29-9-1)41-24-5-2-18-38(41)45-33(19-13-25-42(45)51)31-14-10-15-32(30-31)48-52-49(39-22-11-20-36-34-16-3-6-26-43(34)55-46(36)39)54-50(53-48)40-23-12-21-37-35-17-4-7-27-44(35)56-47(37)40/h2-7,10-32H,1,8-9,33-34H2;2-7,10-30,33-34H,1,8-9,31-32H2;2-7,10-27,30H,1,8-9,28-29H2
InChIKeyFUFSZEUKYYHCON-UHFFFAOYSA-N
MW2317.78 g/mol
LogP44.04
Rot. Bonds14

About 2,4-di(dibenzofuran-1-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-2-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-4-yl)-6-(3-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)-1,3,5-triazine

2,4-di(dibenzofuran-1-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-2-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-4-yl)-6-(3-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)-1,3,5-triazine (PubChem CID 158143524) has the molecular formula C165H113N9O6 and a molecular weight of 2317.78 g/mol. Its IUPAC name is 2,4-di(dibenzofuran-1-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-2-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-4-yl)-6-(3-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)-1,3,5-triazine.

Molecular Properties

Compound Name2,4-di(dibenzofuran-1-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-2-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-4-yl)-6-(3-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)-1,3,5-triazine
PubChem CID158143524
Molecular FormulaC165H113N9O6
Molecular Weight2317.78 g/mol
Exact Mass2315.88
IUPAC Name2,4-di(dibenzofuran-1-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-2-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-4-yl)-6-(3-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)-1,3,5-triazine
SMILESc1cc(-c2nc(-c3cccc4c3oc3ccccc34)nc(-c3cccc4c3oc3ccccc34)n2)cc(-c2cccc3c2-c2ccccc2C32CCCCC2)c1.c1ccc2c(c1)-c1c(-c3ccc(-c4ccc(-c5nc(-c6ccc7oc8ccccc8c7c6)nc(-c6ccc7oc8ccccc8c7c6)n5)cc4)cc3)cccc1C21CCCCC1.c1ccc2c(c1)-c1c(-c3ccc(-c4ccc(-c5nc(-c6cccc7oc8ccccc8c67)nc(-c6cccc7oc8ccccc8c67)n5)cc4)cc3)cccc1C21CCCCC1
InChIInChI=1S/2C57H39N3O2.C51H35N3O2/c1-8-33-57(34-9-1)45-19-5-2-13-40(45)51-39(16-10-20-46(51)57)37-29-25-35(26-30-37)36-27-31-38(32-28-36)54-58-55(43-17-11-23-49-52(43)41-14-3-6-21-47(41)61-49)60-56(59-54)44-18-12-24-50-53(44)42-15-4-7-22-48(42)62-50;1-8-31-57(32-9-1)47-15-5-2-13-44(47)53-41(14-10-16-48(53)57)37-23-19-35(20-24-37)36-21-25-38(26-22-36)54-58-55(39-27-29-51-45(33-39)42-11-3-6-17-49(42)61-51)60-56(59-54)40-28-30-52-46(34-40)43-12-4-7-18-50(43)62-52;1-8-28-51(29-9-1)41-24-5-2-18-38(41)45-33(19-13-25-42(45)51)31-14-10-15-32(30-31)48-52-49(39-22-11-20-36-34-16-3-6-26-43(34)55-46(36)39)54-50(53-48)40-23-12-21-37-35-17-4-7-27-44(35)56-47(37)40/h2-7,10-32H,1,8-9,33-34H2;2-7,10-30,33-34H,1,8-9,31-32H2;2-7,10-27,30H,1,8-9,28-29H2
InChIKeyFUFSZEUKYYHCON-UHFFFAOYSA-N
XLogP44.04
TPSA194.85 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds14
Heavy Atoms180
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002317.78
LogP ≤ 544.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 2,4-di(dibenzofuran-1-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-2-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-4-yl)-6-(3-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)-1,3,5-triazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2,4-di(dibenzofuran-1-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-2-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-4-yl)-6-(3-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)-1,3,5-triazine?
The IUPAC name of 2,4-di(dibenzofuran-1-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-2-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-4-yl)-6-(3-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)-1,3,5-triazine (CID 158143524) is 2,4-di(dibenzofuran-1-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-2-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-4-yl)-6-(3-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)-1,3,5-triazine.
What is the SMILES notation for 2,4-di(dibenzofuran-1-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-2-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-4-yl)-6-(3-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)-1,3,5-triazine?
The canonical SMILES for 2,4-di(dibenzofuran-1-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-2-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-4-yl)-6-(3-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)-1,3,5-triazine is c1cc(-c2nc(-c3cccc4c3oc3ccccc34)nc(-c3cccc4c3oc3ccccc34)n2)cc(-c2cccc3c2-c2ccccc2C32CCCCC2)c1.c1ccc2c(c1)-c1c(-c3ccc(-c4ccc(-c5nc(-c6ccc7oc8ccccc8c7c6)nc(-c6ccc7oc8ccccc8c7c6)n5)cc4)cc3)cccc1C21CCCCC1.c1ccc2c(c1)-c1c(-c3ccc(-c4ccc(-c5nc(-c6cccc7oc8ccccc8c67)nc(-c6cccc7oc8ccccc8c67)n5)cc4)cc3)cccc1C21CCCCC1.
What is the InChIKey of 2,4-di(dibenzofuran-1-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-2-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-4-yl)-6-(3-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)-1,3,5-triazine?
The InChIKey is FUFSZEUKYYHCON-UHFFFAOYSA-N. The full InChI is InChI=1S/2C57H39N3O2.C51H35N3O2/c1-8-33-57(34-9-1)45-19-5-2-13-40(45)51-39(16-10-20-46(51)57)37-29-25-35(26-30-37)36-27-31-38(32-28-36)54-58-55(43-17-11-23-49-52(43)41-14-3-6-21-47(41)61-49)60-56(59-54)44-18-12-24-50-53(44)42-15-4-7-22-48(42)62-50;1-8-31-57(32-9-1)47-15-5-2-13-44(47)53-41(14-10-16-48(53)57)37-23-19-35(20-24-37)36-21-25-38(26-22-36)54-58-55(39-27-29-51-45(33-39)42-11-3-6-17-49(42)61-51)60-56(59-54)40-28-30-52-46(34-40)43-12-4-7-18-50(43)62-52;1-8-28-51(29-9-1)41-24-5-2-18-38(41)45-33(19-13-25-42(45)51)31-14-10-15-32(30-31)48-52-49(39-22-11-20-36-34-16-3-6-26-43(34)55-46(36)39)54-50(53-48)40-23-12-21-37-35-17-4-7-27-44(35)56-47(37)40/h2-7,10-32H,1,8-9,33-34H2;2-7,10-30,33-34H,1,8-9,31-32H2;2-7,10-27,30H,1,8-9,28-29H2.
What are the key properties of 2,4-di(dibenzofuran-1-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-2-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-4-yl)-6-(3-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)-1,3,5-triazine?
2,4-di(dibenzofuran-1-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-2-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-4-yl)-6-(3-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)-1,3,5-triazine has a molecular weight of 2317.78 g/mol, XLogP of 44.04, 14 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-di(dibenzofuran-1-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-2-yl)-6-[4-(4-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)phenyl]-1,3,5-triazine;2,4-di(dibenzofuran-4-yl)-6-(3-spiro[cyclohexane-1,9'-fluorene]-4'-ylphenyl)-1,3,5-triazine is sourced from PubChem (CID 158143524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).