4-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine

C165H104N18 — CID 162128056

IUPAC4-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc(-c5nc6ccccc6c6ccc7c(nc(-c8ccccc8)n7-c7ccccc7)c56)cc4)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4cc(-c5ccc(-c6nc7ccccc7c7ccc8c(nc(-c9ccccc9)n8-c8ccccc8)c67)cc5)ccc4c3)n2)cc1.c1ccc(-c2nc3c4c(-c5ccc(-c6nc(-c7cccc8ccccc78)nc(-c7cccc8ccccc78)n6)cc5)nc5ccccc5c4ccc3n2-c2ccccc2)cc1
InChIInChI=1S/C57H36N6.C55H34N6.C53H34N6/c1-5-15-39(16-6-1)54-60-55(40-17-7-2-8-18-40)62-56(61-54)45-32-31-43-35-42(29-30-44(43)36-45)37-25-27-38(28-26-37)52-51-48(47-23-13-14-24-49(47)58-52)33-34-50-53(51)59-57(41-19-9-3-10-20-41)63(50)46-21-11-4-12-22-46;1-3-17-39(18-4-1)55-57-51-48(61(55)40-21-5-2-6-22-40)34-33-44-43-25-11-12-28-47(43)56-50(49(44)51)37-29-31-38(32-30-37)52-58-53(45-26-13-19-35-15-7-9-23-41(35)45)60-54(59-52)46-27-14-20-36-16-8-10-24-42(36)46;1-5-15-38(16-6-1)50-56-51(39-17-7-2-8-18-39)58-52(57-50)40-31-27-36(28-32-40)35-25-29-37(30-26-35)48-47-44(43-23-13-14-24-45(43)54-48)33-34-46-49(47)55-53(41-19-9-3-10-20-41)59(46)42-21-11-4-12-22-42/h1-36H;1-34H;1-34H
InChIKeyZIHLWHJFFLECDN-UHFFFAOYSA-N
MW2338.77 g/mol
LogP40.53
Rot. Bonds20

About 4-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine

4-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine (PubChem CID 162128056) has the molecular formula C165H104N18 and a molecular weight of 2338.77 g/mol. Its IUPAC name is 4-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine.

Molecular Properties

Compound Name4-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine
PubChem CID162128056
Molecular FormulaC165H104N18
Molecular Weight2338.77 g/mol
Exact Mass2336.87
IUPAC Name4-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc(-c5nc6ccccc6c6ccc7c(nc(-c8ccccc8)n7-c7ccccc7)c56)cc4)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4cc(-c5ccc(-c6nc7ccccc7c7ccc8c(nc(-c9ccccc9)n8-c8ccccc8)c67)cc5)ccc4c3)n2)cc1.c1ccc(-c2nc3c4c(-c5ccc(-c6nc(-c7cccc8ccccc78)nc(-c7cccc8ccccc78)n6)cc5)nc5ccccc5c4ccc3n2-c2ccccc2)cc1
InChIInChI=1S/C57H36N6.C55H34N6.C53H34N6/c1-5-15-39(16-6-1)54-60-55(40-17-7-2-8-18-40)62-56(61-54)45-32-31-43-35-42(29-30-44(43)36-45)37-25-27-38(28-26-37)52-51-48(47-23-13-14-24-49(47)58-52)33-34-50-53(51)59-57(41-19-9-3-10-20-41)63(50)46-21-11-4-12-22-46;1-3-17-39(18-4-1)55-57-51-48(61(55)40-21-5-2-6-22-40)34-33-44-43-25-11-12-28-47(43)56-50(49(44)51)37-29-31-38(32-30-37)52-58-53(45-26-13-19-35-15-7-9-23-41(35)45)60-54(59-52)46-27-14-20-36-16-8-10-24-42(36)46;1-5-15-38(16-6-1)50-56-51(39-17-7-2-8-18-39)58-52(57-50)40-31-27-36(28-32-40)35-25-29-37(30-26-35)48-47-44(43-23-13-14-24-45(43)54-48)33-34-46-49(47)55-53(41-19-9-3-10-20-41)59(46)42-21-11-4-12-22-42/h1-36H;1-34H;1-34H
InChIKeyZIHLWHJFFLECDN-UHFFFAOYSA-N
XLogP40.53
TPSA208.14 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds20
Heavy Atoms183
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002338.77
LogP ≤ 540.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

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

Analyze 4-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine with MolForge

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Related Compounds

4-[4-[2,6-bis(4-phenylphenyl)pyrimidin-4-yl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-(2,6-dinaphthalen-1-ylpyrimidin-4-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;1,2-diphenyl-4-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]imidazo[4,5-i]phenanthridine
CID 161373189
4-[4-[4-[2,6-bis(3-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;1,2-diphenyl-4-[4-[6-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-2-yl]phenyl]imidazo[4,5-i]phenanthridine;1,2-diphenyl-4-[4-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]imidazo[4,5-i]phenanthridine
CID 157409017
4-[4-(2,6-dinaphthalen-1-ylpyrimidin-4-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-(2,6-dinaphthalen-2-ylpyrimidin-4-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-(2,6-dipyridin-4-ylpyrimidin-4-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine
CID 161353496
4-[4-(4-naphthalen-1-ylquinazolin-2-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine
CID 139498569
4-[4-(4,6-dinaphthalen-1-ylpyrimidin-2-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-(4,6-dipyridin-4-ylpyrimidin-2-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine
CID 159870424
1,2-diphenyl-4-[4-[3-(4-phenylquinazolin-2-yl)phenyl]phenyl]imidazo[4,5-i]phenanthridine
CID 139498645
1,2-diphenyl-4-[4-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]phenyl]imidazo[4,5-i]phenanthridine
CID 139498575
1,2-diphenyl-4-[4-[3-(2-phenylquinazolin-4-yl)phenyl]phenyl]imidazo[4,5-i]phenanthridine
CID 139498536
1,2-diphenyl-4-(4-quinolin-3-ylphenyl)imidazo[4,5-i]phenanthridine
CID 139498552
4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine
CID 139498872
4-[4-(3,5-diphenylphenyl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine
CID 139498588
4-(4-phenanthren-9-ylphenyl)-1,2-diphenylimidazo[4,5-i]phenanthridine
CID 139498636

Frequently Asked Questions

What is the IUPAC name of 4-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine?
The IUPAC name of 4-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine (CID 162128056) is 4-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine.
What is the SMILES notation for 4-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine?
The canonical SMILES for 4-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine is c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc(-c5nc6ccccc6c6ccc7c(nc(-c8ccccc8)n7-c7ccccc7)c56)cc4)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4cc(-c5ccc(-c6nc7ccccc7c7ccc8c(nc(-c9ccccc9)n8-c8ccccc8)c67)cc5)ccc4c3)n2)cc1.c1ccc(-c2nc3c4c(-c5ccc(-c6nc(-c7cccc8ccccc78)nc(-c7cccc8ccccc78)n6)cc5)nc5ccccc5c4ccc3n2-c2ccccc2)cc1.
What is the InChIKey of 4-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine?
The InChIKey is ZIHLWHJFFLECDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H36N6.C55H34N6.C53H34N6/c1-5-15-39(16-6-1)54-60-55(40-17-7-2-8-18-40)62-56(61-54)45-32-31-43-35-42(29-30-44(43)36-45)37-25-27-38(28-26-37)52-51-48(47-23-13-14-24-49(47)58-52)33-34-50-53(51)59-57(41-19-9-3-10-20-41)63(50)46-21-11-4-12-22-46;1-3-17-39(18-4-1)55-57-51-48(61(55)40-21-5-2-6-22-40)34-33-44-43-25-11-12-28-47(43)56-50(49(44)51)37-29-31-38(32-30-37)52-58-53(45-26-13-19-35-15-7-9-23-41(35)45)60-54(59-52)46-27-14-20-36-16-8-10-24-42(36)46;1-5-15-38(16-6-1)50-56-51(39-17-7-2-8-18-39)58-52(57-50)40-31-27-36(28-32-40)35-25-29-37(30-26-35)48-47-44(43-23-13-14-24-45(43)54-48)33-34-46-49(47)55-53(41-19-9-3-10-20-41)59(46)42-21-11-4-12-22-42/h1-36H;1-34H;1-34H.
What are the key properties of 4-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine?
4-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine has a molecular weight of 2338.77 g/mol, XLogP of 40.53, 20 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine;4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2-diphenylimidazo[4,5-i]phenanthridine is sourced from PubChem (CID 162128056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).