bis(2-(2-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole);2-(4-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole

C153H96N12O3 — CID 159318420

IUPACbis(2-(2-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole);2-(4-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5ccc(-c6ccc(-c7cccc8oc9ccccc9c78)cc6)cc54)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5ccc(-c6ccccc6-c6cccc7oc8ccccc8c67)cc54)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5ccc(-c6ccccc6-c6cccc7oc8ccccc8c67)cc54)c3)n2)cc1
InChIInChI=1S/3C51H32N4O/c1-3-13-35(14-4-1)49-52-50(36-15-5-2-6-16-36)54-51(53-49)38-17-11-18-39(31-38)55-44-22-9-7-19-41(44)42-30-29-37(32-45(42)55)33-25-27-34(28-26-33)40-21-12-24-47-48(40)43-20-8-10-23-46(43)56-47;2*1-3-15-33(16-4-1)49-52-50(34-17-5-2-6-18-34)54-51(53-49)36-19-13-20-37(31-36)55-44-26-11-9-23-40(44)41-30-29-35(32-45(41)55)38-21-7-8-22-39(38)42-25-14-28-47-48(42)43-24-10-12-27-46(43)56-47/h3*1-32H
InChIKeyLDLFSPAZZSBBLT-UHFFFAOYSA-N
MW2150.53 g/mol
LogP39.61
Rot. Bonds18

About bis(2-(2-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole);2-(4-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole

bis(2-(2-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole);2-(4-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole (PubChem CID 159318420) has the molecular formula C153H96N12O3 and a molecular weight of 2150.53 g/mol. Its IUPAC name is bis(2-(2-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole);2-(4-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole.

Molecular Properties

Compound Namebis(2-(2-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole);2-(4-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
PubChem CID159318420
Molecular FormulaC153H96N12O3
Molecular Weight2150.53 g/mol
Exact Mass2148.77
IUPAC Namebis(2-(2-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole);2-(4-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5ccc(-c6ccc(-c7cccc8oc9ccccc9c78)cc6)cc54)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5ccc(-c6ccccc6-c6cccc7oc8ccccc8c67)cc54)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5ccc(-c6ccccc6-c6cccc7oc8ccccc8c67)cc54)c3)n2)cc1
InChIInChI=1S/3C51H32N4O/c1-3-13-35(14-4-1)49-52-50(36-15-5-2-6-16-36)54-51(53-49)38-17-11-18-39(31-38)55-44-22-9-7-19-41(44)42-30-29-37(32-45(42)55)33-25-27-34(28-26-33)40-21-12-24-47-48(40)43-20-8-10-23-46(43)56-47;2*1-3-15-33(16-4-1)49-52-50(34-17-5-2-6-18-34)54-51(53-49)36-19-13-20-37(31-36)55-44-26-11-9-23-40(44)41-30-29-35(32-45(41)55)38-21-7-8-22-39(38)42-25-14-28-47-48(42)43-24-10-12-27-46(43)56-47/h3*1-32H
InChIKeyLDLFSPAZZSBBLT-UHFFFAOYSA-N
XLogP39.61
TPSA170.22 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds18
Heavy Atoms168
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002150.53
LogP ≤ 539.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze bis(2-(2-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole);2-(4-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of bis(2-(2-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole);2-(4-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole?
The IUPAC name of bis(2-(2-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole);2-(4-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole (CID 159318420) is bis(2-(2-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole);2-(4-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole.
What is the SMILES notation for bis(2-(2-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole);2-(4-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole?
The canonical SMILES for bis(2-(2-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole);2-(4-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole is c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5ccc(-c6ccc(-c7cccc8oc9ccccc9c78)cc6)cc54)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5ccc(-c6ccccc6-c6cccc7oc8ccccc8c67)cc54)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5ccc(-c6ccccc6-c6cccc7oc8ccccc8c67)cc54)c3)n2)cc1.
What is the InChIKey of bis(2-(2-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole);2-(4-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole?
The InChIKey is LDLFSPAZZSBBLT-UHFFFAOYSA-N. The full InChI is InChI=1S/3C51H32N4O/c1-3-13-35(14-4-1)49-52-50(36-15-5-2-6-16-36)54-51(53-49)38-17-11-18-39(31-38)55-44-22-9-7-19-41(44)42-30-29-37(32-45(42)55)33-25-27-34(28-26-33)40-21-12-24-47-48(40)43-20-8-10-23-46(43)56-47;2*1-3-15-33(16-4-1)49-52-50(34-17-5-2-6-18-34)54-51(53-49)36-19-13-20-37(31-36)55-44-26-11-9-23-40(44)41-30-29-35(32-45(41)55)38-21-7-8-22-39(38)42-25-14-28-47-48(42)43-24-10-12-27-46(43)56-47/h3*1-32H.
What are the key properties of bis(2-(2-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole);2-(4-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole?
bis(2-(2-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole);2-(4-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole has a molecular weight of 2150.53 g/mol, XLogP of 39.61, 18 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-(2-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole);2-(4-dibenzofuran-1-ylphenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole is sourced from PubChem (CID 159318420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).