3-[3-[2,6-bis(4-phenylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline;2-[3-[2,6-bis(3-phenylphenyl)-4-pyridinyl]-5-quinolin-2-ylphenyl]quinoline;3-[3-[2,6-bis(4-pyridin-2-ylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline

C157H103N11 — CID 163983947

IUPAC3-[3-[2,6-bis(4-phenylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline;2-[3-[2,6-bis(3-phenylphenyl)-4-pyridinyl]-5-quinolin-2-ylphenyl]quinoline;3-[3-[2,6-bis(4-pyridin-2-ylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline
SMILESc1ccc(-c2ccc(-c3cc(-c4cc(-c5cc6ccccc6cn5)cc(-c5cc6ccccc6cn5)c4)cc(-c4ccc(-c5ccccc5)cc4)n3)cc2)cc1.c1ccc(-c2ccc(-c3cc(-c4cc(-c5cc6ccccc6cn5)cc(-c5cc6ccccc6cn5)c4)cc(-c4ccc(-c5ccccn5)cc4)n3)cc2)nc1.c1ccc(-c2cccc(-c3cc(-c4cc(-c5ccc6ccccc6n5)cc(-c5ccc6ccccc6n5)c4)cc(-c4cccc(-c5ccccc5)c4)n3)c2)cc1
InChIInChI=1S/2C53H35N3.C51H33N5/c1-3-13-36(14-4-1)40-19-11-21-42(29-40)52-34-45(35-53(56-52)43-22-12-20-41(30-43)37-15-5-2-6-16-37)44-31-46(50-27-25-38-17-7-9-23-48(38)54-50)33-47(32-44)51-28-26-39-18-8-10-24-49(39)55-51;1-3-11-36(12-4-1)38-19-23-40(24-20-38)52-32-47(33-53(56-52)41-25-21-39(22-26-41)37-13-5-2-6-14-37)46-27-48(50-30-42-15-7-9-17-44(42)34-54-50)29-49(28-46)51-31-43-16-8-10-18-45(43)35-55-51;1-3-11-40-32-54-48(28-38(40)9-1)44-25-42(26-45(27-44)49-29-39-10-2-4-12-41(39)33-55-49)43-30-50(36-19-15-34(16-20-36)46-13-5-7-23-52-46)56-51(31-43)37-21-17-35(18-22-37)47-14-6-8-24-53-47/h2*1-35H;1-33H
InChIKeyTURIMTUHTMRERY-UHFFFAOYSA-N
MW2143.63 g/mol
LogP40.33
Rot. Bonds21

About 3-[3-[2,6-bis(4-phenylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline;2-[3-[2,6-bis(3-phenylphenyl)-4-pyridinyl]-5-quinolin-2-ylphenyl]quinoline;3-[3-[2,6-bis(4-pyridin-2-ylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline

3-[3-[2,6-bis(4-phenylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline;2-[3-[2,6-bis(3-phenylphenyl)-4-pyridinyl]-5-quinolin-2-ylphenyl]quinoline;3-[3-[2,6-bis(4-pyridin-2-ylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline (PubChem CID 163983947) has the molecular formula C157H103N11 and a molecular weight of 2143.63 g/mol. Its IUPAC name is 3-[3-[2,6-bis(4-phenylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline;2-[3-[2,6-bis(3-phenylphenyl)-4-pyridinyl]-5-quinolin-2-ylphenyl]quinoline;3-[3-[2,6-bis(4-pyridin-2-ylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline.

Molecular Properties

Compound Name3-[3-[2,6-bis(4-phenylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline;2-[3-[2,6-bis(3-phenylphenyl)-4-pyridinyl]-5-quinolin-2-ylphenyl]quinoline;3-[3-[2,6-bis(4-pyridin-2-ylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline
PubChem CID163983947
Molecular FormulaC157H103N11
Molecular Weight2143.63 g/mol
Exact Mass2141.84
IUPAC Name3-[3-[2,6-bis(4-phenylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline;2-[3-[2,6-bis(3-phenylphenyl)-4-pyridinyl]-5-quinolin-2-ylphenyl]quinoline;3-[3-[2,6-bis(4-pyridin-2-ylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline
SMILESc1ccc(-c2ccc(-c3cc(-c4cc(-c5cc6ccccc6cn5)cc(-c5cc6ccccc6cn5)c4)cc(-c4ccc(-c5ccccc5)cc4)n3)cc2)cc1.c1ccc(-c2ccc(-c3cc(-c4cc(-c5cc6ccccc6cn5)cc(-c5cc6ccccc6cn5)c4)cc(-c4ccc(-c5ccccn5)cc4)n3)cc2)nc1.c1ccc(-c2cccc(-c3cc(-c4cc(-c5ccc6ccccc6n5)cc(-c5ccc6ccccc6n5)c4)cc(-c4cccc(-c5ccccc5)c4)n3)c2)cc1
InChIInChI=1S/2C53H35N3.C51H33N5/c1-3-13-36(14-4-1)40-19-11-21-42(29-40)52-34-45(35-53(56-52)43-22-12-20-41(30-43)37-15-5-2-6-16-37)44-31-46(50-27-25-38-17-7-9-23-48(38)54-50)33-47(32-44)51-28-26-39-18-8-10-24-49(39)55-51;1-3-11-36(12-4-1)38-19-23-40(24-20-38)52-32-47(33-53(56-52)41-25-21-39(22-26-41)37-13-5-2-6-14-37)46-27-48(50-30-42-15-7-9-17-44(42)34-54-50)29-49(28-46)51-31-43-16-8-10-18-45(43)35-55-51;1-3-11-40-32-54-48(28-38(40)9-1)44-25-42(26-45(27-44)49-29-39-10-2-4-12-41(39)33-55-49)43-30-50(36-19-15-34(16-20-36)46-13-5-7-23-52-46)56-51(31-43)37-21-17-35(18-22-37)47-14-6-8-24-53-47/h2*1-35H;1-33H
InChIKeyTURIMTUHTMRERY-UHFFFAOYSA-N
XLogP40.33
TPSA141.79 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds21
Heavy Atoms168
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002143.63
LogP ≤ 540.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 3-[3-[2,6-bis(4-phenylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline;2-[3-[2,6-bis(3-phenylphenyl)-4-pyridinyl]-5-quinolin-2-ylphenyl]quinoline;3-[3-[2,6-bis(4-pyridin-2-ylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline with MolForge

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Related Compounds

3-[4-[2,6-bis(3-pyridin-2-ylphenyl)pyrimidin-4-yl]phenyl]isoquinoline
CID 122427585
2,6-diphenyl-4-[3-(3-pyridin-2-ylphenyl)phenyl]pyridine
CID 140587116
2-[3-[2-(3,5-dipyridin-2-ylphenyl)quinolin-6-yl]phenyl]benzo[g]quinoline
CID 139363998
2-[4-(2,6-dipyridin-3-yl-4-pyridinyl)phenyl]-6-(2-phenylquinolin-6-yl)quinoline;2-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-(2-pyridin-2-ylquinolin-6-yl)quinoline
CID 159059555
7-[3,5-di(quinolin-4-yl)phenyl]-2-[2-(3-pyridin-2-ylphenyl)quinolin-7-yl]quinoline;2-phenyl-9-[3-[2-[2-(3-phenylphenyl)quinolin-7-yl]quinolin-7-yl]phenyl]-1,10-phenanthroline
CID 165060350
22-(3-pyridin-2-ylphenyl)-52,55-diazatridecacyclo[41.8.4.22,5.211,14.230,33.239,42.16,10.115,19.120,24.125,29.134,38.046,54.049,53]octahexaconta-1(52),2(68),3,5(67),6,8,10(66),11(65),12,14(64),15(63),16,18,20(62),21,23,25,27,29(61),30,32,34(58),35,37,39,41,43(55),44,46(54),47,49(53),50,56,59-tetratriacontaene
CID 140920150
2-(3-methylphenyl)pyridine;bis(2-phenylquinoline);ruthenium(3+)
CID 172795269
4-(3,5-dipyridin-2-ylphenyl)-2,6-bis(4-pyridin-2-ylphenyl)pyridine
CID 118582537
1-[3-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]phenyl]-3-phenylbenzo[f]quinoline
CID 146185389
3-[3-[4,6-bis(3,5-diphenylphenyl)pyrimidin-2-yl]phenyl]isoquinoline
CID 140786223
4-[3,5-bis(4-phenyl-2-pyridinyl)phenyl]-2,6-diphenylpyridine;2-(3,5-dinaphthalen-1-ylphenyl)-4,6-bis(4-pyridin-2-ylphenyl)pyrimidine;2,6-diphenyl-4-[3-phenyl-5-(5-phenyl-2-pyridinyl)phenyl]pyridine
CID 159726197
2-[3-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)-5-isoquinolin-3-ylphenyl]quinoline
CID 118582341

Frequently Asked Questions

What is the IUPAC name of 3-[3-[2,6-bis(4-phenylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline;2-[3-[2,6-bis(3-phenylphenyl)-4-pyridinyl]-5-quinolin-2-ylphenyl]quinoline;3-[3-[2,6-bis(4-pyridin-2-ylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline?
The IUPAC name of 3-[3-[2,6-bis(4-phenylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline;2-[3-[2,6-bis(3-phenylphenyl)-4-pyridinyl]-5-quinolin-2-ylphenyl]quinoline;3-[3-[2,6-bis(4-pyridin-2-ylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline (CID 163983947) is 3-[3-[2,6-bis(4-phenylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline;2-[3-[2,6-bis(3-phenylphenyl)-4-pyridinyl]-5-quinolin-2-ylphenyl]quinoline;3-[3-[2,6-bis(4-pyridin-2-ylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline.
What is the SMILES notation for 3-[3-[2,6-bis(4-phenylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline;2-[3-[2,6-bis(3-phenylphenyl)-4-pyridinyl]-5-quinolin-2-ylphenyl]quinoline;3-[3-[2,6-bis(4-pyridin-2-ylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline?
The canonical SMILES for 3-[3-[2,6-bis(4-phenylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline;2-[3-[2,6-bis(3-phenylphenyl)-4-pyridinyl]-5-quinolin-2-ylphenyl]quinoline;3-[3-[2,6-bis(4-pyridin-2-ylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline is c1ccc(-c2ccc(-c3cc(-c4cc(-c5cc6ccccc6cn5)cc(-c5cc6ccccc6cn5)c4)cc(-c4ccc(-c5ccccc5)cc4)n3)cc2)cc1.c1ccc(-c2ccc(-c3cc(-c4cc(-c5cc6ccccc6cn5)cc(-c5cc6ccccc6cn5)c4)cc(-c4ccc(-c5ccccn5)cc4)n3)cc2)nc1.c1ccc(-c2cccc(-c3cc(-c4cc(-c5ccc6ccccc6n5)cc(-c5ccc6ccccc6n5)c4)cc(-c4cccc(-c5ccccc5)c4)n3)c2)cc1.
What is the InChIKey of 3-[3-[2,6-bis(4-phenylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline;2-[3-[2,6-bis(3-phenylphenyl)-4-pyridinyl]-5-quinolin-2-ylphenyl]quinoline;3-[3-[2,6-bis(4-pyridin-2-ylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline?
The InChIKey is TURIMTUHTMRERY-UHFFFAOYSA-N. The full InChI is InChI=1S/2C53H35N3.C51H33N5/c1-3-13-36(14-4-1)40-19-11-21-42(29-40)52-34-45(35-53(56-52)43-22-12-20-41(30-43)37-15-5-2-6-16-37)44-31-46(50-27-25-38-17-7-9-23-48(38)54-50)33-47(32-44)51-28-26-39-18-8-10-24-49(39)55-51;1-3-11-36(12-4-1)38-19-23-40(24-20-38)52-32-47(33-53(56-52)41-25-21-39(22-26-41)37-13-5-2-6-14-37)46-27-48(50-30-42-15-7-9-17-44(42)34-54-50)29-49(28-46)51-31-43-16-8-10-18-45(43)35-55-51;1-3-11-40-32-54-48(28-38(40)9-1)44-25-42(26-45(27-44)49-29-39-10-2-4-12-41(39)33-55-49)43-30-50(36-19-15-34(16-20-36)46-13-5-7-23-52-46)56-51(31-43)37-21-17-35(18-22-37)47-14-6-8-24-53-47/h2*1-35H;1-33H.
What are the key properties of 3-[3-[2,6-bis(4-phenylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline;2-[3-[2,6-bis(3-phenylphenyl)-4-pyridinyl]-5-quinolin-2-ylphenyl]quinoline;3-[3-[2,6-bis(4-pyridin-2-ylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline?
3-[3-[2,6-bis(4-phenylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline;2-[3-[2,6-bis(3-phenylphenyl)-4-pyridinyl]-5-quinolin-2-ylphenyl]quinoline;3-[3-[2,6-bis(4-pyridin-2-ylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline has a molecular weight of 2143.63 g/mol, XLogP of 40.33, 21 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-[2,6-bis(4-phenylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline;2-[3-[2,6-bis(3-phenylphenyl)-4-pyridinyl]-5-quinolin-2-ylphenyl]quinoline;3-[3-[2,6-bis(4-pyridin-2-ylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline is sourced from PubChem (CID 163983947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).