3-[3-(3-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(4-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;2-phenyl-3-[4-[4-(2-phenylphenanthro[9,10-b]pyrazin-3-yl)phenyl]phenyl]phenanthro[9,10-b]pyrazine

C144H86N12 — CID 159278418

IUPAC3-[3-(3-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(4-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;2-phenyl-3-[4-[4-(2-phenylphenanthro[9,10-b]pyrazin-3-yl)phenyl]phenyl]phenanthro[9,10-b]pyrazine
SMILESc1cc(-c2cccc(-c3cnc4c5ccccc5c5ccccc5c4n3)c2)cc(-c2cnc3c4ccccc4c4ccccc4c3n2)c1.c1ccc(-c2nc3c4ccccc4c4ccccc4c3nc2-c2ccc(-c3ccc(-c4nc5c6ccccc6c6ccccc6c5nc4-c4ccccc4)cc3)cc2)cc1.c1ccc2c(c1)c1ccccc1c1nc(-c3ccc(-c4ccc(-c5cnc6c7ccccc7c7ccccc7c6n5)cc4)cc3)cnc21
InChIInChI=1S/C56H34N4.2C44H26N4/c1-3-15-37(16-4-1)49-51(59-55-47-25-13-9-21-43(47)41-19-7-11-23-45(41)53(55)57-49)39-31-27-35(28-32-39)36-29-33-40(34-30-36)52-50(38-17-5-2-6-18-38)58-54-46-24-12-8-20-42(46)44-22-10-14-26-48(44)56(54)60-52;1-5-19-35-31(15-1)33-17-3-7-21-37(33)43-41(35)45-25-39(47-43)29-13-9-11-27(23-29)28-12-10-14-30(24-28)40-26-46-42-36-20-6-2-16-32(36)34-18-4-8-22-38(34)44(42)48-40;1-5-13-35-31(9-1)33-11-3-7-15-37(33)43-41(35)45-25-39(47-43)29-21-17-27(18-22-29)28-19-23-30(24-20-28)40-26-46-42-36-14-6-2-10-32(36)34-12-4-8-16-38(34)44(42)48-40/h1-34H;2*1-26H
InChIKeyKYPJNSLFJKTZHH-UHFFFAOYSA-N
MW1984.36 g/mol
LogP36.89
Rot. Bonds11

About 3-[3-(3-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(4-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;2-phenyl-3-[4-[4-(2-phenylphenanthro[9,10-b]pyrazin-3-yl)phenyl]phenyl]phenanthro[9,10-b]pyrazine

3-[3-(3-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(4-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;2-phenyl-3-[4-[4-(2-phenylphenanthro[9,10-b]pyrazin-3-yl)phenyl]phenyl]phenanthro[9,10-b]pyrazine (PubChem CID 159278418) has the molecular formula C144H86N12 and a molecular weight of 1984.36 g/mol. Its IUPAC name is 3-[3-(3-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(4-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;2-phenyl-3-[4-[4-(2-phenylphenanthro[9,10-b]pyrazin-3-yl)phenyl]phenyl]phenanthro[9,10-b]pyrazine.

Molecular Properties

Compound Name3-[3-(3-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(4-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;2-phenyl-3-[4-[4-(2-phenylphenanthro[9,10-b]pyrazin-3-yl)phenyl]phenyl]phenanthro[9,10-b]pyrazine
PubChem CID159278418
Molecular FormulaC144H86N12
Molecular Weight1984.36 g/mol
Exact Mass1982.71
IUPAC Name3-[3-(3-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(4-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;2-phenyl-3-[4-[4-(2-phenylphenanthro[9,10-b]pyrazin-3-yl)phenyl]phenyl]phenanthro[9,10-b]pyrazine
SMILESc1cc(-c2cccc(-c3cnc4c5ccccc5c5ccccc5c4n3)c2)cc(-c2cnc3c4ccccc4c4ccccc4c3n2)c1.c1ccc(-c2nc3c4ccccc4c4ccccc4c3nc2-c2ccc(-c3ccc(-c4nc5c6ccccc6c6ccccc6c5nc4-c4ccccc4)cc3)cc2)cc1.c1ccc2c(c1)c1ccccc1c1nc(-c3ccc(-c4ccc(-c5cnc6c7ccccc7c7ccccc7c6n5)cc4)cc3)cnc21
InChIInChI=1S/C56H34N4.2C44H26N4/c1-3-15-37(16-4-1)49-51(59-55-47-25-13-9-21-43(47)41-19-7-11-23-45(41)53(55)57-49)39-31-27-35(28-32-39)36-29-33-40(34-30-36)52-50(38-17-5-2-6-18-38)58-54-46-24-12-8-20-42(46)44-22-10-14-26-48(44)56(54)60-52;1-5-19-35-31(15-1)33-17-3-7-21-37(33)43-41(35)45-25-39(47-43)29-13-9-11-27(23-29)28-12-10-14-30(24-28)40-26-46-42-36-20-6-2-16-32(36)34-18-4-8-22-38(34)44(42)48-40;1-5-13-35-31(9-1)33-11-3-7-15-37(33)43-41(35)45-25-39(47-43)29-21-17-27(18-22-29)28-19-23-30(24-20-28)40-26-46-42-36-14-6-2-10-32(36)34-12-4-8-16-38(34)44(42)48-40/h1-34H;2*1-26H
InChIKeyKYPJNSLFJKTZHH-UHFFFAOYSA-N
XLogP36.89
TPSA154.68 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds11
Heavy Atoms156
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001984.36
LogP ≤ 536.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

Analyze 3-[3-(3-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(4-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;2-phenyl-3-[4-[4-(2-phenylphenanthro[9,10-b]pyrazin-3-yl)phenyl]phenyl]phenanthro[9,10-b]pyrazine with MolForge

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Related Compounds

3-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]phenanthro[9,10-b]pyrazine
CID 163903392
3-[3-phenanthren-9-yl-5-[6-phenyl-4-(3-phenylphenyl)-2-pyridinyl]phenyl]phenanthro[9,10-b]pyrazine
CID 176622478
3-[3-[4-[3-(6-naphthalen-1-yldibenzothiophen-4-yl)phenyl]phenyl]phenyl]phenanthro[9,10-b]pyrazine;3-[3-[3-[3-(6-phenyldibenzothiophen-4-yl)phenyl]phenyl]phenyl]phenanthro[9,10-b]pyrazine;3-[3-[3-[4-(6-phenyldibenzothiophen-4-yl)phenyl]phenyl]phenyl]phenanthro[9,10-b]pyrazine;3-[3-[4-[3-(6-phenyldibenzothiophen-4-yl)phenyl]phenyl]phenyl]phenanthro[9,10-b]pyrazine;3-[3-[4-[4-(6-phenyldibenzothiophen-4-yl)phenyl]phenyl]phenyl]phenanthro[9,10-b]pyrazine;3-[4-[3-[4-(6-phenyldibenzothiophen-4-yl)phenyl]phenyl]phenyl]phenanthro[9,10-b]pyrazine
CID 158191248
3-[4-[4-[3-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]phenanthro[9,10-b]pyrazine
CID 129063744
3-[3-[4-(4-dibenzofuran-2-ylphenyl)phenyl]phenyl]phenanthro[9,10-b]pyrazine
CID 129063437
6,11-diphenyl-3-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]phenanthro[9,10-b]pyrazine;7,10-diphenyl-3-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]phenanthro[9,10-b]pyrazine;3-[3-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]phenyl]phenanthro[9,10-b]pyrazine;3-[3-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]phenyl]phenanthro[9,10-b]pyrazine;2-phenyl-3-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]phenanthro[9,10-b]pyrazine;3-[3-[3-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]phenanthro[9,10-b]pyrazine
CID 159665602
3-[4-[3-(3-carbazol-9-ylphenyl)phenyl]phenyl]phenanthro[9,10-b]pyrazine
CID 129063610
3-[4-[3-[3-(3-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]phenanthro[9,10-b]pyrazine
CID 129063751
3-[4-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]phenanthro[9,10-b]pyrazine
CID 129063891
3-[3-[3-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]phenyl]phenanthro[9,10-b]pyrazine
CID 129064112
3-[3-[3-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]phenyl]phenanthro[9,10-b]pyrazine
CID 129064106
3-[3-[3-[2,8-bis(3-phenylphenyl)dibenzothiophen-4-yl]phenyl]phenyl]phenanthro[9,10-b]pyrazine
CID 89425352

Frequently Asked Questions

What is the IUPAC name of 3-[3-(3-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(4-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;2-phenyl-3-[4-[4-(2-phenylphenanthro[9,10-b]pyrazin-3-yl)phenyl]phenyl]phenanthro[9,10-b]pyrazine?
The IUPAC name of 3-[3-(3-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(4-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;2-phenyl-3-[4-[4-(2-phenylphenanthro[9,10-b]pyrazin-3-yl)phenyl]phenyl]phenanthro[9,10-b]pyrazine (CID 159278418) is 3-[3-(3-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(4-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;2-phenyl-3-[4-[4-(2-phenylphenanthro[9,10-b]pyrazin-3-yl)phenyl]phenyl]phenanthro[9,10-b]pyrazine.
What is the SMILES notation for 3-[3-(3-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(4-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;2-phenyl-3-[4-[4-(2-phenylphenanthro[9,10-b]pyrazin-3-yl)phenyl]phenyl]phenanthro[9,10-b]pyrazine?
The canonical SMILES for 3-[3-(3-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(4-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;2-phenyl-3-[4-[4-(2-phenylphenanthro[9,10-b]pyrazin-3-yl)phenyl]phenyl]phenanthro[9,10-b]pyrazine is c1cc(-c2cccc(-c3cnc4c5ccccc5c5ccccc5c4n3)c2)cc(-c2cnc3c4ccccc4c4ccccc4c3n2)c1.c1ccc(-c2nc3c4ccccc4c4ccccc4c3nc2-c2ccc(-c3ccc(-c4nc5c6ccccc6c6ccccc6c5nc4-c4ccccc4)cc3)cc2)cc1.c1ccc2c(c1)c1ccccc1c1nc(-c3ccc(-c4ccc(-c5cnc6c7ccccc7c7ccccc7c6n5)cc4)cc3)cnc21.
What is the InChIKey of 3-[3-(3-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(4-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;2-phenyl-3-[4-[4-(2-phenylphenanthro[9,10-b]pyrazin-3-yl)phenyl]phenyl]phenanthro[9,10-b]pyrazine?
The InChIKey is KYPJNSLFJKTZHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H34N4.2C44H26N4/c1-3-15-37(16-4-1)49-51(59-55-47-25-13-9-21-43(47)41-19-7-11-23-45(41)53(55)57-49)39-31-27-35(28-32-39)36-29-33-40(34-30-36)52-50(38-17-5-2-6-18-38)58-54-46-24-12-8-20-42(46)44-22-10-14-26-48(44)56(54)60-52;1-5-19-35-31(15-1)33-17-3-7-21-37(33)43-41(35)45-25-39(47-43)29-13-9-11-27(23-29)28-12-10-14-30(24-28)40-26-46-42-36-20-6-2-16-32(36)34-18-4-8-22-38(34)44(42)48-40;1-5-13-35-31(9-1)33-11-3-7-15-37(33)43-41(35)45-25-39(47-43)29-21-17-27(18-22-29)28-19-23-30(24-20-28)40-26-46-42-36-14-6-2-10-32(36)34-12-4-8-16-38(34)44(42)48-40/h1-34H;2*1-26H.
What are the key properties of 3-[3-(3-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(4-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;2-phenyl-3-[4-[4-(2-phenylphenanthro[9,10-b]pyrazin-3-yl)phenyl]phenyl]phenanthro[9,10-b]pyrazine?
3-[3-(3-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(4-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;2-phenyl-3-[4-[4-(2-phenylphenanthro[9,10-b]pyrazin-3-yl)phenyl]phenyl]phenanthro[9,10-b]pyrazine has a molecular weight of 1984.36 g/mol, XLogP of 36.89, 11 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(3-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(4-phenanthro[9,10-b]pyrazin-3-ylphenyl)phenyl]phenanthro[9,10-b]pyrazine;2-phenyl-3-[4-[4-(2-phenylphenanthro[9,10-b]pyrazin-3-yl)phenyl]phenyl]phenanthro[9,10-b]pyrazine is sourced from PubChem (CID 159278418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).