3-[4-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,8-dinaphthalen-2-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(6-phenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,6,8-triphenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine

C192H116N12O4 — CID 158912213

About 3-[4-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,8-dinaphthalen-2-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(6-phenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,6,8-triphenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine

3-[4-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,8-dinaphthalen-2-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(6-phenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,6,8-triphenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine (PubChem CID 158912213) has the molecular formula C192H116N12O4 and a molecular weight of 2655.12 g/mol. Its IUPAC name is 3-[4-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,8-dinaphthalen-2-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(6-phenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,6,8-triphenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine.

Molecular Properties

• Compound Name: 3-[4-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,8-dinaphthalen-2-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(6-phenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,6,8-triphenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine
• PubChem CID: 158912213
• Molecular Formula: C192H116N12O4
• Molecular Weight: 2655.12 g/mol
• Exact Mass: 2652.92
• IUPAC Name: 3-[4-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,8-dinaphthalen-2-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(6-phenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,6,8-triphenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine
• SMILES: c1ccc(-c2cc(-c3ccccc3)c3oc4c(-c5ccc(-c6nnc7c8ccccc8c8ccccc8n67)cc5)cc(-c5ccccc5)cc4c3c2)cc1.c1ccc(-c2cccc3c2oc2c(-c4ccc(-c5nnc6c7ccccc7c7ccccc7n56)cc4)cccc23)cc1.c1ccc2c(-c3ccc4oc5c(-c6ccc(-c7nnc8c9ccccc9c9ccccc9n78)cc6)cc(-c6cccc7ccccc67)cc5c4c3)cccc2c1.c1ccc2cc(-c3ccc4oc5c(-c6ccc(-c7nnc8c9ccccc9c9ccccc9n78)cc6)cc(-c6ccc7ccccc7c6)cc5c4c3)ccc2c1
• InChI: InChI=1S/2C52H31N3O.C50H31N3O.C38H23N3O/c1-3-15-38-32(11-1)13-9-20-40(38)36-27-28-49-46(29-36)47-31-37(41-21-10-14-33-12-2-4-16-39(33)41)30-45(50(47)56-49)34-23-25-35(26-24-34)51-53-54-52-44-19-6-5-17-42(44)43-18-7-8-22-48(43)55(51)52;1-3-11-36-27-38(23-17-32(36)9-1)40-25-26-49-46(29-40)47-31-41(39-24-18-33-10-2-4-12-37(33)28-39)30-45(50(47)56-49)34-19-21-35(22-20-34)51-53-54-52-44-15-6-5-13-42(44)43-14-7-8-16-48(43)55(51)52;1-4-14-32(15-5-1)37-28-42(34-18-8-3-9-19-34)47-44(30-37)45-31-38(33-16-6-2-7-17-33)29-43(48(45)54-47)35-24-26-36(27-25-35)49-51-52-50-41-22-11-10-20-39(41)40-21-12-13-23-46(40)53(49)50;1-2-10-24(11-3-1)27-15-8-17-31-32-18-9-16-28(36(32)42-35(27)31)25-20-22-26(23-21-25)37-39-40-38-33-14-5-4-12-29(33)30-13-6-7-19-34(30)41(37)38/h2*1-31H;1-31H;1-23H
• InChIKey: JGUFYDWCHRYVTK-UHFFFAOYSA-N
• XLogP: 51.03
• TPSA: 173.32 Ų
• H-Bond Acceptors: 16
• Rotatable Bonds: 16
• Heavy Atoms: 208
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2655.12
LogP ≤ 5	51.03
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-[4-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,8-dinaphthalen-2-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(6-phenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,6,8-triphenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine?

The IUPAC name of 3-[4-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,8-dinaphthalen-2-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(6-phenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,6,8-triphenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine (CID 158912213) is 3-[4-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,8-dinaphthalen-2-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(6-phenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,6,8-triphenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine.

What is the SMILES notation for 3-[4-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,8-dinaphthalen-2-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(6-phenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,6,8-triphenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine?

The canonical SMILES for 3-[4-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,8-dinaphthalen-2-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(6-phenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,6,8-triphenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine is c1ccc(-c2cc(-c3ccccc3)c3oc4c(-c5ccc(-c6nnc7c8ccccc8c8ccccc8n67)cc5)cc(-c5ccccc5)cc4c3c2)cc1.c1ccc(-c2cccc3c2oc2c(-c4ccc(-c5nnc6c7ccccc7c7ccccc7n56)cc4)cccc23)cc1.c1ccc2c(-c3ccc4oc5c(-c6ccc(-c7nnc8c9ccccc9c9ccccc9n78)cc6)cc(-c6cccc7ccccc67)cc5c4c3)cccc2c1.c1ccc2cc(-c3ccc4oc5c(-c6ccc(-c7nnc8c9ccccc9c9ccccc9n78)cc6)cc(-c6ccc7ccccc7c6)cc5c4c3)ccc2c1.

What is the InChIKey of 3-[4-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,8-dinaphthalen-2-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(6-phenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,6,8-triphenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine?

The InChIKey is JGUFYDWCHRYVTK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C52H31N3O.C50H31N3O.C38H23N3O/c1-3-15-38-32(11-1)13-9-20-40(38)36-27-28-49-46(29-36)47-31-37(41-21-10-14-33-12-2-4-16-39(33)41)30-45(50(47)56-49)34-23-25-35(26-24-34)51-53-54-52-44-19-6-5-17-42(44)43-18-7-8-22-48(43)55(51)52;1-3-11-36-27-38(23-17-32(36)9-1)40-25-26-49-46(29-40)47-31-41(39-24-18-33-10-2-4-12-37(33)28-39)30-45(50(47)56-49)34-19-21-35(22-20-34)51-53-54-52-44-15-6-5-13-42(44)43-14-7-8-16-48(43)55(51)52;1-4-14-32(15-5-1)37-28-42(34-18-8-3-9-19-34)47-44(30-37)45-31-38(33-16-6-2-7-17-33)29-43(48(45)54-47)35-24-26-36(27-25-35)49-51-52-50-41-22-11-10-20-39(41)40-21-12-13-23-46(40)53(49)50;1-2-10-24(11-3-1)27-15-8-17-31-32-18-9-16-28(36(32)42-35(27)31)25-20-22-26(23-21-25)37-39-40-38-33-14-5-4-12-29(33)30-13-6-7-19-34(30)41(37)38/h2*1-31H;1-31H;1-23H.

What are the key properties of 3-[4-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,8-dinaphthalen-2-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(6-phenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,6,8-triphenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine?

3-[4-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,8-dinaphthalen-2-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(6-phenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,6,8-triphenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine has a molecular weight of 2655.12 g/mol, XLogP of 51.03, 16 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[4-(2,8-dinaphthalen-1-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,8-dinaphthalen-2-yldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(6-phenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine;3-[4-(2,6,8-triphenyldibenzofuran-4-yl)phenyl]-[1,2,4]triazolo[4,3-f]phenanthridine is sourced from PubChem (CID 158912213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).