4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-6,10-diphenylphenanthridine;6,10-diphenyl-4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenanthridine;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6,10-diphenylphenanthridine

C156H102N12 — CID 159557083

IUPAC4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-6,10-diphenylphenanthridine;6,10-diphenyl-4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenanthridine;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6,10-diphenylphenanthridine
SMILESc1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4cccc(-c5cccc6c5nc(-c5ccccc5)c5cccc(-c7ccccc7)c56)c4)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-c5cccc6c5nc(-c5ccccc5)c5cccc(-c7ccccc7)c56)c4)n3)cc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4cccc5c4nc(-c4ccccc4)c4cccc(-c6ccccc6)c45)c3)n2)cc1
InChIInChI=1S/C58H38N4.C52H34N4.C46H30N4/c1-5-16-39(17-6-1)41-30-34-45(35-31-41)56-60-57(46-36-32-42(33-37-46)40-18-7-2-8-19-40)62-58(61-56)48-25-13-24-47(38-48)50-27-15-29-52-53-49(43-20-9-3-10-21-43)26-14-28-51(53)54(59-55(50)52)44-22-11-4-12-23-44;1-5-16-35(17-6-1)36-30-32-40(33-31-36)51-54-50(39-22-11-4-12-23-39)55-52(56-51)42-25-13-24-41(34-42)44-27-15-29-46-47-43(37-18-7-2-8-19-37)26-14-28-45(47)48(53-49(44)46)38-20-9-3-10-21-38;1-5-16-31(17-6-1)37-26-14-28-39-41(37)40-29-15-27-38(43(40)47-42(39)32-18-7-2-8-19-32)35-24-13-25-36(30-35)46-49-44(33-20-9-3-10-21-33)48-45(50-46)34-22-11-4-12-23-34/h1-38H;1-34H;1-30H
InChIKeyMGDBAAUHGYFEBY-UHFFFAOYSA-N
MW2144.62 g/mol
LogP39.73
Rot. Bonds21

About 4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-6,10-diphenylphenanthridine;6,10-diphenyl-4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenanthridine;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6,10-diphenylphenanthridine

4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-6,10-diphenylphenanthridine;6,10-diphenyl-4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenanthridine;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6,10-diphenylphenanthridine (PubChem CID 159557083) has the molecular formula C156H102N12 and a molecular weight of 2144.62 g/mol. Its IUPAC name is 4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-6,10-diphenylphenanthridine;6,10-diphenyl-4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenanthridine;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6,10-diphenylphenanthridine.

Molecular Properties

Compound Name4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-6,10-diphenylphenanthridine;6,10-diphenyl-4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenanthridine;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6,10-diphenylphenanthridine
PubChem CID159557083
Molecular FormulaC156H102N12
Molecular Weight2144.62 g/mol
Exact Mass2142.84
IUPAC Name4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-6,10-diphenylphenanthridine;6,10-diphenyl-4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenanthridine;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6,10-diphenylphenanthridine
SMILESc1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4cccc(-c5cccc6c5nc(-c5ccccc5)c5cccc(-c7ccccc7)c56)c4)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-c5cccc6c5nc(-c5ccccc5)c5cccc(-c7ccccc7)c56)c4)n3)cc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4cccc5c4nc(-c4ccccc4)c4cccc(-c6ccccc6)c45)c3)n2)cc1
InChIInChI=1S/C58H38N4.C52H34N4.C46H30N4/c1-5-16-39(17-6-1)41-30-34-45(35-31-41)56-60-57(46-36-32-42(33-37-46)40-18-7-2-8-19-40)62-58(61-56)48-25-13-24-47(38-48)50-27-15-29-52-53-49(43-20-9-3-10-21-43)26-14-28-51(53)54(59-55(50)52)44-22-11-4-12-23-44;1-5-16-35(17-6-1)36-30-32-40(33-31-36)51-54-50(39-22-11-4-12-23-39)55-52(56-51)42-25-13-24-41(34-42)44-27-15-29-46-47-43(37-18-7-2-8-19-37)26-14-28-45(47)48(53-49(44)46)38-20-9-3-10-21-38;1-5-16-31(17-6-1)37-26-14-28-39-41(37)40-29-15-27-38(43(40)47-42(39)32-18-7-2-8-19-32)35-24-13-25-36(30-35)46-49-44(33-20-9-3-10-21-33)48-45(50-46)34-22-11-4-12-23-34/h1-38H;1-34H;1-30H
InChIKeyMGDBAAUHGYFEBY-UHFFFAOYSA-N
XLogP39.73
TPSA154.68 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds21
Heavy Atoms168
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002144.62
LogP ≤ 539.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

Analyze 4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-6,10-diphenylphenanthridine;6,10-diphenyl-4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenanthridine;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6,10-diphenylphenanthridine with MolForge

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Related Compounds

4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6,10-diphenylphenanthridine
CID 146548291
4-[4-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-6,10-diphenylphenanthridine
CID 146549107
4-[3-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]-6,10-diphenylphenanthridine
CID 146549222
4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6,10-diphenylphenanthridine
CID 146548674
6,10-diphenyl-4-[3-[6-phenyl-2-(3-phenylphenyl)pyrimidin-4-yl]phenyl]phenanthridine
CID 146548667
4-[4-[4,6-di(phenanthren-9-yl)-1,3,5-triazin-2-yl]phenyl]-6,10-diphenylphenanthridine
CID 146549913
4-[3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylbenzo[k]phenanthridine
CID 148540354
4-[3-[4-(4-cyclohexa-1,5-dien-1-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6,10-diphenylphenanthridine
CID 146548647
3-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-6,10-diphenylphenanthridine
CID 146548561
6,10-diphenyl-3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenanthridine
CID 146548609
4-[4-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6,10-diphenylphenanthridine;4-[4-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-pyridinyl]phenyl]-6,10-diphenylphenanthridine
CID 160572866
4-[3-[2,6-bis(4-methylphenyl)pyrimidin-4-yl]phenyl]-6,10-diphenylphenanthridine;4-[3-(2,6-dinaphthalen-2-ylpyrimidin-4-yl)phenyl]-6,10-diphenylphenanthridine;4-[3-[6-(3,5-diphenylphenyl)-2-phenylpyrimidin-4-yl]phenyl]-6,10-diphenylphenanthridine;ethane
CID 159016436

Frequently Asked Questions

What is the IUPAC name of 4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-6,10-diphenylphenanthridine;6,10-diphenyl-4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenanthridine;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6,10-diphenylphenanthridine?
The IUPAC name of 4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-6,10-diphenylphenanthridine;6,10-diphenyl-4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenanthridine;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6,10-diphenylphenanthridine (CID 159557083) is 4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-6,10-diphenylphenanthridine;6,10-diphenyl-4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenanthridine;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6,10-diphenylphenanthridine.
What is the SMILES notation for 4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-6,10-diphenylphenanthridine;6,10-diphenyl-4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenanthridine;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6,10-diphenylphenanthridine?
The canonical SMILES for 4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-6,10-diphenylphenanthridine;6,10-diphenyl-4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenanthridine;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6,10-diphenylphenanthridine is c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4cccc(-c5cccc6c5nc(-c5ccccc5)c5cccc(-c7ccccc7)c56)c4)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-c5cccc6c5nc(-c5ccccc5)c5cccc(-c7ccccc7)c56)c4)n3)cc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4cccc5c4nc(-c4ccccc4)c4cccc(-c6ccccc6)c45)c3)n2)cc1.
What is the InChIKey of 4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-6,10-diphenylphenanthridine;6,10-diphenyl-4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenanthridine;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6,10-diphenylphenanthridine?
The InChIKey is MGDBAAUHGYFEBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H38N4.C52H34N4.C46H30N4/c1-5-16-39(17-6-1)41-30-34-45(35-31-41)56-60-57(46-36-32-42(33-37-46)40-18-7-2-8-19-40)62-58(61-56)48-25-13-24-47(38-48)50-27-15-29-52-53-49(43-20-9-3-10-21-43)26-14-28-51(53)54(59-55(50)52)44-22-11-4-12-23-44;1-5-16-35(17-6-1)36-30-32-40(33-31-36)51-54-50(39-22-11-4-12-23-39)55-52(56-51)42-25-13-24-41(34-42)44-27-15-29-46-47-43(37-18-7-2-8-19-37)26-14-28-45(47)48(53-49(44)46)38-20-9-3-10-21-38;1-5-16-31(17-6-1)37-26-14-28-39-41(37)40-29-15-27-38(43(40)47-42(39)32-18-7-2-8-19-32)35-24-13-25-36(30-35)46-49-44(33-20-9-3-10-21-33)48-45(50-46)34-22-11-4-12-23-34/h1-38H;1-34H;1-30H.
What are the key properties of 4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-6,10-diphenylphenanthridine;6,10-diphenyl-4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenanthridine;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6,10-diphenylphenanthridine?
4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-6,10-diphenylphenanthridine;6,10-diphenyl-4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenanthridine;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6,10-diphenylphenanthridine has a molecular weight of 2144.62 g/mol, XLogP of 39.73, 21 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-6,10-diphenylphenanthridine;6,10-diphenyl-4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenanthridine;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6,10-diphenylphenanthridine is sourced from PubChem (CID 159557083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).