9-(3-dibenzofuran-2-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-3-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-4-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine

C156H102N12O3 — CID 159648707

IUPAC9-(3-dibenzofuran-2-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-3-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-4-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine
SMILESc1ccc(-c2nc(-c3ccccc3)nc(N3c4ccccc4C(c4ccccc4)(c4cccc(-c5ccc6c(c5)oc5ccccc56)c4)c4ccccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(N3c4ccccc4C(c4ccccc4)(c4cccc(-c5ccc6oc7ccccc7c6c5)c4)c4ccccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(N3c4ccccc4C(c4ccccc4)(c4cccc(-c5cccc6c5oc5ccccc56)c4)c4ccccc43)n2)cc1
InChIInChI=1S/3C52H34N4O/c1-4-18-35(19-5-1)49-53-50(36-20-6-2-7-21-36)55-51(54-49)56-45-31-13-11-29-43(45)52(38-23-8-3-9-24-38,44-30-12-14-32-46(44)56)39-25-16-22-37(34-39)40-27-17-28-42-41-26-10-15-33-47(41)57-48(40)42;1-4-17-35(18-5-1)49-53-50(36-19-6-2-7-20-36)55-51(54-49)56-45-28-13-11-26-43(45)52(39-22-8-3-9-23-39,44-27-12-14-29-46(44)56)40-24-16-21-37(33-40)38-31-32-48-42(34-38)41-25-10-15-30-47(41)57-48;1-4-17-35(18-5-1)49-53-50(36-19-6-2-7-20-36)55-51(54-49)56-45-28-13-11-26-43(45)52(39-22-8-3-9-23-39,44-27-12-14-29-46(44)56)40-24-16-21-37(33-40)38-31-32-42-41-25-10-15-30-47(41)57-48(42)34-38/h3*1-34H
InChIKeyMRHCZVSJJRCFGU-UHFFFAOYSA-N
MW2192.61 g/mol
LogP38.81
Rot. Bonds18

About 9-(3-dibenzofuran-2-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-3-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-4-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine

9-(3-dibenzofuran-2-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-3-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-4-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine (PubChem CID 159648707) has the molecular formula C156H102N12O3 and a molecular weight of 2192.61 g/mol. Its IUPAC name is 9-(3-dibenzofuran-2-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-3-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-4-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine.

Molecular Properties

Compound Name9-(3-dibenzofuran-2-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-3-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-4-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine
PubChem CID159648707
Molecular FormulaC156H102N12O3
Molecular Weight2192.61 g/mol
Exact Mass2190.82
IUPAC Name9-(3-dibenzofuran-2-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-3-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-4-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine
SMILESc1ccc(-c2nc(-c3ccccc3)nc(N3c4ccccc4C(c4ccccc4)(c4cccc(-c5ccc6c(c5)oc5ccccc56)c4)c4ccccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(N3c4ccccc4C(c4ccccc4)(c4cccc(-c5ccc6oc7ccccc7c6c5)c4)c4ccccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(N3c4ccccc4C(c4ccccc4)(c4cccc(-c5cccc6c5oc5ccccc56)c4)c4ccccc43)n2)cc1
InChIInChI=1S/3C52H34N4O/c1-4-18-35(19-5-1)49-53-50(36-20-6-2-7-21-36)55-51(54-49)56-45-31-13-11-29-43(45)52(38-23-8-3-9-24-38,44-30-12-14-32-46(44)56)39-25-16-22-37(34-39)40-27-17-28-42-41-26-10-15-33-47(41)57-48(40)42;1-4-17-35(18-5-1)49-53-50(36-19-6-2-7-20-36)55-51(54-49)56-45-28-13-11-26-43(45)52(39-22-8-3-9-23-39,44-27-12-14-29-46(44)56)40-24-16-21-37(33-40)38-31-32-48-42(34-38)41-25-10-15-30-47(41)57-48;1-4-17-35(18-5-1)49-53-50(36-19-6-2-7-20-36)55-51(54-49)56-45-28-13-11-26-43(45)52(39-22-8-3-9-23-39,44-27-12-14-29-46(44)56)40-24-16-21-37(33-40)38-31-32-42-41-25-10-15-30-47(41)57-48(42)34-38/h3*1-34H
InChIKeyMRHCZVSJJRCFGU-UHFFFAOYSA-N
XLogP38.81
TPSA165.15 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds18
Heavy Atoms171
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002192.61
LogP ≤ 538.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 9-(3-dibenzofuran-2-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-3-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-4-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-(3-dibenzofuran-2-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-3-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-4-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine?
The IUPAC name of 9-(3-dibenzofuran-2-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-3-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-4-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine (CID 159648707) is 9-(3-dibenzofuran-2-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-3-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-4-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine.
What is the SMILES notation for 9-(3-dibenzofuran-2-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-3-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-4-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine?
The canonical SMILES for 9-(3-dibenzofuran-2-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-3-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-4-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine is c1ccc(-c2nc(-c3ccccc3)nc(N3c4ccccc4C(c4ccccc4)(c4cccc(-c5ccc6c(c5)oc5ccccc56)c4)c4ccccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(N3c4ccccc4C(c4ccccc4)(c4cccc(-c5ccc6oc7ccccc7c6c5)c4)c4ccccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(N3c4ccccc4C(c4ccccc4)(c4cccc(-c5cccc6c5oc5ccccc56)c4)c4ccccc43)n2)cc1.
What is the InChIKey of 9-(3-dibenzofuran-2-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-3-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-4-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine?
The InChIKey is MRHCZVSJJRCFGU-UHFFFAOYSA-N. The full InChI is InChI=1S/3C52H34N4O/c1-4-18-35(19-5-1)49-53-50(36-20-6-2-7-21-36)55-51(54-49)56-45-31-13-11-29-43(45)52(38-23-8-3-9-24-38,44-30-12-14-32-46(44)56)39-25-16-22-37(34-39)40-27-17-28-42-41-26-10-15-33-47(41)57-48(40)42;1-4-17-35(18-5-1)49-53-50(36-19-6-2-7-20-36)55-51(54-49)56-45-28-13-11-26-43(45)52(39-22-8-3-9-23-39,44-27-12-14-29-46(44)56)40-24-16-21-37(33-40)38-31-32-48-42(34-38)41-25-10-15-30-47(41)57-48;1-4-17-35(18-5-1)49-53-50(36-19-6-2-7-20-36)55-51(54-49)56-45-28-13-11-26-43(45)52(39-22-8-3-9-23-39,44-27-12-14-29-46(44)56)40-24-16-21-37(33-40)38-31-32-42-41-25-10-15-30-47(41)57-48(42)34-38/h3*1-34H.
What are the key properties of 9-(3-dibenzofuran-2-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-3-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-4-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine?
9-(3-dibenzofuran-2-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-3-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-4-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine has a molecular weight of 2192.61 g/mol, XLogP of 38.81, 18 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(3-dibenzofuran-2-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-3-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine;9-(3-dibenzofuran-4-ylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylacridine is sourced from PubChem (CID 159648707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).