2-phenyl-4-(2-phenylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(3-pyridin-3-ylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,10-phenanthroline

C137H91N15 — CID 161151459

IUPAC2-phenyl-4-(2-phenylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(3-pyridin-3-ylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,10-phenanthroline
SMILESc1ccc(-c2nc(-c3cccc(-c4cccnc4)c3)nc(-c3cccc(-c4nc(-c5ccccc5)c(-c5ccccc5)nc4-c4ccccc4)c3)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4nc(-c5ccccc5)c(-c5ccccc5)nc4-c4ccccc4)c3)nc(-c3ccccc3-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)c(-c3cccc(-c4ccc5ccc6cccnc6c5n4)c3)nc2-c2ccccc2)cc1
InChIInChI=1S/C49H33N5.C48H32N6.C40H26N4/c1-6-19-34(20-7-1)41-31-16-17-32-42(41)49-53-47(38-27-14-5-15-28-38)52-48(54-49)40-30-18-29-39(33-40)46-45(37-25-12-4-13-26-37)50-43(35-21-8-2-9-22-35)44(51-46)36-23-10-3-11-24-36;1-5-16-33(17-6-1)42-43(34-18-7-2-8-19-34)51-45(44(50-42)35-20-9-3-10-21-35)38-25-14-27-40(31-38)48-53-46(36-22-11-4-12-23-36)52-47(54-48)39-26-13-24-37(30-39)41-28-15-29-49-32-41;1-4-12-27(13-5-1)37-38(28-14-6-2-7-15-28)44-40(39(43-37)29-16-8-3-9-17-29)33-19-10-18-32(26-33)34-24-23-31-22-21-30-20-11-25-41-35(30)36(31)42-34/h1-33H;1-32H;1-26H
InChIKeyUOSQZJCFYGGQSY-UHFFFAOYSA-N
MW1947.34 g/mol
LogP33.30
Rot. Bonds21

About 2-phenyl-4-(2-phenylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(3-pyridin-3-ylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,10-phenanthroline

2-phenyl-4-(2-phenylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(3-pyridin-3-ylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,10-phenanthroline (PubChem CID 161151459) has the molecular formula C137H91N15 and a molecular weight of 1947.34 g/mol. Its IUPAC name is 2-phenyl-4-(2-phenylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(3-pyridin-3-ylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,10-phenanthroline.

Molecular Properties

Compound Name2-phenyl-4-(2-phenylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(3-pyridin-3-ylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,10-phenanthroline
PubChem CID161151459
Molecular FormulaC137H91N15
Molecular Weight1947.34 g/mol
Exact Mass1945.76
IUPAC Name2-phenyl-4-(2-phenylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(3-pyridin-3-ylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,10-phenanthroline
SMILESc1ccc(-c2nc(-c3cccc(-c4cccnc4)c3)nc(-c3cccc(-c4nc(-c5ccccc5)c(-c5ccccc5)nc4-c4ccccc4)c3)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4nc(-c5ccccc5)c(-c5ccccc5)nc4-c4ccccc4)c3)nc(-c3ccccc3-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)c(-c3cccc(-c4ccc5ccc6cccnc6c5n4)c3)nc2-c2ccccc2)cc1
InChIInChI=1S/C49H33N5.C48H32N6.C40H26N4/c1-6-19-34(20-7-1)41-31-16-17-32-42(41)49-53-47(38-27-14-5-15-28-38)52-48(54-49)40-30-18-29-39(33-40)46-45(37-25-12-4-13-26-37)50-43(35-21-8-2-9-22-35)44(51-46)36-23-10-3-11-24-36;1-5-16-33(17-6-1)42-43(34-18-7-2-8-19-34)51-45(44(50-42)35-20-9-3-10-21-35)38-25-14-27-40(31-38)48-53-46(36-22-11-4-12-23-36)52-47(54-48)39-26-13-24-37(30-39)41-28-15-29-49-32-41;1-4-12-27(13-5-1)37-38(28-14-6-2-7-15-28)44-40(39(43-37)29-16-8-3-9-17-29)33-19-10-18-32(26-33)34-24-23-31-22-21-30-20-11-25-41-35(30)36(31)42-34/h1-33H;1-32H;1-26H
InChIKeyUOSQZJCFYGGQSY-UHFFFAOYSA-N
XLogP33.30
TPSA193.35 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds21
Heavy Atoms152
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001947.34
LogP ≤ 533.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

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

Analyze 2-phenyl-4-(2-phenylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(3-pyridin-3-ylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,10-phenanthroline with MolForge

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Related Compounds

2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-phenylphenyl]-1,10-phenanthroline
CID 142752628
3-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,10-phenanthroline;2-phenyl-4-(4-phenylphenyl)-6-[4-[4-(4-pyridin-3-ylphenyl)naphthalen-1-yl]phenyl]-1,3,5-triazine;2-phenyl-4-(2-phenylphenyl)-6-[4-[4-(4-pyridin-3-ylphenyl)phenyl]naphthalen-1-yl]-1,3,5-triazine;3-[4-[4-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-1,10-phenanthroline
CID 167595480
2-(3-phenylphenyl)-1,10-phenanthroline
CID 118188250
bis(2,4-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazine);2-phenyl-4,6-bis[3-[3-(2-pyridin-2-ylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[3-[3-(5-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]-1,3,5-triazine
CID 158902539
2,4-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazine;2-phenyl-4,6-bis[3-[3-(2-pyridin-2-ylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[3-[3-(5-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]-1,3,5-triazine
CID 159312458
2-naphthalen-2-yl-4-phenyl-6-[2-phenyl-4-(2-phenyl-4-pyridin-3-ylphenyl)phenyl]-1,3,5-triazine
CID 175394211
2-[3-(2,3,5,6-tetraphenyl-4-pyridinyl)phenyl]-1,10-phenanthroline
CID 167363724
2,4-diphenyl-6-[3-phenyl-5-[3-[3-[3-(2-phenylphenyl)phenyl]phenyl]phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-phenyl-5-[3-[2-(2-phenylphenyl)phenyl]phenyl]phenyl]-1,3,5-triazine;2-[3-[3-phenyl-5-[3-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]-5-pyridin-3-ylphenyl]pyridine;3-[3-[3-phenyl-5-[3-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]-5-pyridin-3-ylphenyl]pyridine
CID 159392802
2-[6-[4-(4-phenylnaphthalen-1-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,10-phenanthroline
CID 176632448
2-[6-(1,10-phenanthrolin-2-yl)-2-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]-1,10-phenanthroline
CID 146474033
8-[4-(3-pyridin-3-ylphenyl)-6-[6-[4-(3-pyridin-3-ylphenyl)-6-quinolin-8-yl-1,3,5-triazin-2-yl]pyren-1-yl]-1,3,5-triazin-2-yl]quinoline
CID 146230726
2-phenyl-4-(2-phenylphenyl)-6-[4-[4-(4-pyridin-3-ylphenyl)phenyl]phenyl]-1,3,5-triazine
CID 165168395

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-4-(2-phenylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(3-pyridin-3-ylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,10-phenanthroline?
The IUPAC name of 2-phenyl-4-(2-phenylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(3-pyridin-3-ylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,10-phenanthroline (CID 161151459) is 2-phenyl-4-(2-phenylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(3-pyridin-3-ylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,10-phenanthroline.
What is the SMILES notation for 2-phenyl-4-(2-phenylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(3-pyridin-3-ylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,10-phenanthroline?
The canonical SMILES for 2-phenyl-4-(2-phenylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(3-pyridin-3-ylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,10-phenanthroline is c1ccc(-c2nc(-c3cccc(-c4cccnc4)c3)nc(-c3cccc(-c4nc(-c5ccccc5)c(-c5ccccc5)nc4-c4ccccc4)c3)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4nc(-c5ccccc5)c(-c5ccccc5)nc4-c4ccccc4)c3)nc(-c3ccccc3-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)c(-c3cccc(-c4ccc5ccc6cccnc6c5n4)c3)nc2-c2ccccc2)cc1.
What is the InChIKey of 2-phenyl-4-(2-phenylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(3-pyridin-3-ylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,10-phenanthroline?
The InChIKey is UOSQZJCFYGGQSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H33N5.C48H32N6.C40H26N4/c1-6-19-34(20-7-1)41-31-16-17-32-42(41)49-53-47(38-27-14-5-15-28-38)52-48(54-49)40-30-18-29-39(33-40)46-45(37-25-12-4-13-26-37)50-43(35-21-8-2-9-22-35)44(51-46)36-23-10-3-11-24-36;1-5-16-33(17-6-1)42-43(34-18-7-2-8-19-34)51-45(44(50-42)35-20-9-3-10-21-35)38-25-14-27-40(31-38)48-53-46(36-22-11-4-12-23-36)52-47(54-48)39-26-13-24-37(30-39)41-28-15-29-49-32-41;1-4-12-27(13-5-1)37-38(28-14-6-2-7-15-28)44-40(39(43-37)29-16-8-3-9-17-29)33-19-10-18-32(26-33)34-24-23-31-22-21-30-20-11-25-41-35(30)36(31)42-34/h1-33H;1-32H;1-26H.
What are the key properties of 2-phenyl-4-(2-phenylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(3-pyridin-3-ylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,10-phenanthroline?
2-phenyl-4-(2-phenylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(3-pyridin-3-ylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,10-phenanthroline has a molecular weight of 1947.34 g/mol, XLogP of 33.30, 21 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-4-(2-phenylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(3-pyridin-3-ylphenyl)-6-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,3,5-triazine;2-[3-(3,5,6-triphenylpyrazin-2-yl)phenyl]-1,10-phenanthroline is sourced from PubChem (CID 161151459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).