5-[5-(4-phenanthren-2-yl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]pyrido[4,3-b]indole;5-[5-(4-phenanthren-2-yl-6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]pyrido[3,2-b]indole;3-[2-pyridin-2-yl-6-(6-pyrido[3,4-b]indol-9-yl-3-pyridinyl)-4-pyridinyl]-1,10-phenanthroline;9-[5-[2-pyridin-2-yl-6-[10-(trifluoromethyl)phenanthren-2-yl]-4-pyridinyl]-2-pyridinyl]pyrido[2,3-b]indole

C159H97F3N22 — CID 161323736

IUPAC5-[5-(4-phenanthren-2-yl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]pyrido[4,3-b]indole;5-[5-(4-phenanthren-2-yl-6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]pyrido[3,2-b]indole;3-[2-pyridin-2-yl-6-(6-pyrido[3,4-b]indol-9-yl-3-pyridinyl)-4-pyridinyl]-1,10-phenanthroline;9-[5-[2-pyridin-2-yl-6-[10-(trifluoromethyl)phenanthren-2-yl]-4-pyridinyl]-2-pyridinyl]pyrido[2,3-b]indole
SMILESFC(F)(F)c1cc2ccccc2c2ccc(-c3cc(-c4ccc(-n5c6ccccc6c6cccnc65)nc4)cc(-c4ccccn4)n3)cc12.c1ccc(-c2cc(-c3ccc4c(ccc5ccccc54)c3)cc(-c3ccc(-n4c5ccccc5c5cnccc54)nc3)n2)nc1.c1ccc(-c2cc(-c3cnc4c(ccc5cccnc54)c3)cc(-c3ccc(-n4c5ccccc5c5ccncc54)nc3)n2)nc1.c1cncc(-c2cc(-c3ccc4c(ccc5ccccc54)c3)cc(-c3ccc(-n4c5ccccc5c5ncccc54)nc3)n2)c1
InChIInChI=1S/C41H24F3N5.2C40H25N5.C38H23N7/c42-41(43,44)34-21-25-8-1-2-9-29(25)30-16-14-26(20-33(30)34)36-22-28(23-37(48-36)35-12-5-6-18-45-35)27-15-17-39(47-24-27)49-38-13-4-3-10-31(38)32-11-7-19-46-40(32)49;1-2-9-32-26(7-1)13-14-28-21-27(15-17-33(28)32)31-22-35(29-8-5-19-41-24-29)44-36(23-31)30-16-18-39(43-25-30)45-37-11-4-3-10-34(37)40-38(45)12-6-20-42-40;1-2-8-31-26(7-1)12-13-28-21-27(14-16-32(28)31)30-22-36(44-37(23-30)35-10-5-6-19-42-35)29-15-17-40(43-24-29)45-38-11-4-3-9-33(38)34-25-41-20-18-39(34)45;1-2-9-34-29(7-1)30-14-17-39-23-35(30)45(34)36-13-12-26(21-42-36)32-19-27(20-33(44-32)31-8-3-4-15-40-31)28-18-25-11-10-24-6-5-16-41-37(24)38(25)43-22-28/h1-24H;2*1-25H;1-23H
InChIKeyVKMKGJJMZCDXMG-UHFFFAOYSA-N
MW2372.67 g/mol
LogP38.49
Rot. Bonds16

About 5-[5-(4-phenanthren-2-yl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]pyrido[4,3-b]indole;5-[5-(4-phenanthren-2-yl-6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]pyrido[3,2-b]indole;3-[2-pyridin-2-yl-6-(6-pyrido[3,4-b]indol-9-yl-3-pyridinyl)-4-pyridinyl]-1,10-phenanthroline;9-[5-[2-pyridin-2-yl-6-[10-(trifluoromethyl)phenanthren-2-yl]-4-pyridinyl]-2-pyridinyl]pyrido[2,3-b]indole

5-[5-(4-phenanthren-2-yl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]pyrido[4,3-b]indole;5-[5-(4-phenanthren-2-yl-6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]pyrido[3,2-b]indole;3-[2-pyridin-2-yl-6-(6-pyrido[3,4-b]indol-9-yl-3-pyridinyl)-4-pyridinyl]-1,10-phenanthroline;9-[5-[2-pyridin-2-yl-6-[10-(trifluoromethyl)phenanthren-2-yl]-4-pyridinyl]-2-pyridinyl]pyrido[2,3-b]indole (PubChem CID 161323736) has the molecular formula C159H97F3N22 and a molecular weight of 2372.67 g/mol. Its IUPAC name is 5-[5-(4-phenanthren-2-yl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]pyrido[4,3-b]indole;5-[5-(4-phenanthren-2-yl-6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]pyrido[3,2-b]indole;3-[2-pyridin-2-yl-6-(6-pyrido[3,4-b]indol-9-yl-3-pyridinyl)-4-pyridinyl]-1,10-phenanthroline;9-[5-[2-pyridin-2-yl-6-[10-(trifluoromethyl)phenanthren-2-yl]-4-pyridinyl]-2-pyridinyl]pyrido[2,3-b]indole.

Molecular Properties

Compound Name5-[5-(4-phenanthren-2-yl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]pyrido[4,3-b]indole;5-[5-(4-phenanthren-2-yl-6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]pyrido[3,2-b]indole;3-[2-pyridin-2-yl-6-(6-pyrido[3,4-b]indol-9-yl-3-pyridinyl)-4-pyridinyl]-1,10-phenanthroline;9-[5-[2-pyridin-2-yl-6-[10-(trifluoromethyl)phenanthren-2-yl]-4-pyridinyl]-2-pyridinyl]pyrido[2,3-b]indole
PubChem CID161323736
Molecular FormulaC159H97F3N22
Molecular Weight2372.67 g/mol
Exact Mass2370.82
IUPAC Name5-[5-(4-phenanthren-2-yl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]pyrido[4,3-b]indole;5-[5-(4-phenanthren-2-yl-6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]pyrido[3,2-b]indole;3-[2-pyridin-2-yl-6-(6-pyrido[3,4-b]indol-9-yl-3-pyridinyl)-4-pyridinyl]-1,10-phenanthroline;9-[5-[2-pyridin-2-yl-6-[10-(trifluoromethyl)phenanthren-2-yl]-4-pyridinyl]-2-pyridinyl]pyrido[2,3-b]indole
SMILESFC(F)(F)c1cc2ccccc2c2ccc(-c3cc(-c4ccc(-n5c6ccccc6c6cccnc65)nc4)cc(-c4ccccn4)n3)cc12.c1ccc(-c2cc(-c3ccc4c(ccc5ccccc54)c3)cc(-c3ccc(-n4c5ccccc5c5cnccc54)nc3)n2)nc1.c1ccc(-c2cc(-c3cnc4c(ccc5cccnc54)c3)cc(-c3ccc(-n4c5ccccc5c5ccncc54)nc3)n2)nc1.c1cncc(-c2cc(-c3ccc4c(ccc5ccccc54)c3)cc(-c3ccc(-n4c5ccccc5c5ncccc54)nc3)n2)c1
InChIInChI=1S/C41H24F3N5.2C40H25N5.C38H23N7/c42-41(43,44)34-21-25-8-1-2-9-29(25)30-16-14-26(20-33(30)34)36-22-28(23-37(48-36)35-12-5-6-18-45-35)27-15-17-39(47-24-27)49-38-13-4-3-10-31(38)32-11-7-19-46-40(32)49;1-2-9-32-26(7-1)13-14-28-21-27(15-17-33(28)32)31-22-35(29-8-5-19-41-24-29)44-36(23-31)30-16-18-39(43-25-30)45-37-11-4-3-10-34(37)40-38(45)12-6-20-42-40;1-2-8-31-26(7-1)12-13-28-21-27(14-16-32(28)31)30-22-36(44-37(23-30)35-10-5-6-19-42-35)29-15-17-40(43-24-29)45-38-11-4-3-9-33(38)34-25-41-20-18-39(34)45;1-2-9-34-29(7-1)30-14-17-39-23-35(30)45(34)36-13-12-26(21-42-36)32-19-27(20-33(44-32)31-8-3-4-15-40-31)28-18-25-11-10-24-6-5-16-41-37(24)38(25)43-22-28/h1-24H;2*1-25H;1-23H
InChIKeyVKMKGJJMZCDXMG-UHFFFAOYSA-N
XLogP38.49
TPSA251.74 Ų
H-Bond Donors
H-Bond Acceptors22
Rotatable Bonds16
Heavy Atoms184
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002372.67
LogP ≤ 538.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

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

Analyze 5-[5-(4-phenanthren-2-yl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]pyrido[4,3-b]indole;5-[5-(4-phenanthren-2-yl-6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]pyrido[3,2-b]indole;3-[2-pyridin-2-yl-6-(6-pyrido[3,4-b]indol-9-yl-3-pyridinyl)-4-pyridinyl]-1,10-phenanthroline;9-[5-[2-pyridin-2-yl-6-[10-(trifluoromethyl)phenanthren-2-yl]-4-pyridinyl]-2-pyridinyl]pyrido[2,3-b]indole with MolForge

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Launch Full Analysis

Related Compounds

US11649237, Example 209
CID 137525203
US11649237, Example 216
CID 137527786
US11649237, Example 212
CID 137527994
US11649237, Example 214
CID 137528026
US11649237, Example 211
CID 137525287
2-Naphthalen-2-yl-3-[[4-[(2-naphthalen-2-ylimidazo[1,2-a]pyrimidin-3-yl)methyl]piperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine
CID 122183056
2-[6-(1H-benzimidazol-2-yl)-2-pyridyl]-1H-benzimidazole; 1,10-phenanthroline; pyrazine; ruthenium(2+); ruthenium(3+); trihexafluorophosphate
CID 11980901
5-(1-Methyl-2,3-dihydroindol-7-yl)-8-[[4-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]phenyl]methyl]-4,6,8,11-tetrazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene
CID 178255053
5-(1-Methylindol-7-yl)-8-[[4-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]phenyl]methyl]-4,6,8,11-tetrazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene
CID 178255054
3,10,20-Tris(trifluoromethyl)-2,4,9,11,14-pentazahexacyclo[10.9.2.05,22.08,23.013,21.014,19]tricosa-1,3,5(22),6,8(23),9,11,13(21),15,17,19-undecaene
CID 72190662
iron(2+);bis(2-[2-(trifluoromethyl)phenyl]-1H-imidazo[4,5-f][1,10]phenanthroline);diisothiocyanate
CID 139166165
7,18-Bis(1,1,2,2,3,3,3-heptafluoropropyl)-10,15,21,25-tetrapyridin-3-yl-6,8,17,19-tetrazaheptacyclo[14.6.2.22,5.03,12.04,9.013,23.020,24]hexacosa-1(22),2(26),3,5(25),6,8,10,12,14,16,18,20,23-tridecaene;oxolane
CID 139184536

Frequently Asked Questions

What is the IUPAC name of 5-[5-(4-phenanthren-2-yl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]pyrido[4,3-b]indole;5-[5-(4-phenanthren-2-yl-6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]pyrido[3,2-b]indole;3-[2-pyridin-2-yl-6-(6-pyrido[3,4-b]indol-9-yl-3-pyridinyl)-4-pyridinyl]-1,10-phenanthroline;9-[5-[2-pyridin-2-yl-6-[10-(trifluoromethyl)phenanthren-2-yl]-4-pyridinyl]-2-pyridinyl]pyrido[2,3-b]indole?
The IUPAC name of 5-[5-(4-phenanthren-2-yl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]pyrido[4,3-b]indole;5-[5-(4-phenanthren-2-yl-6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]pyrido[3,2-b]indole;3-[2-pyridin-2-yl-6-(6-pyrido[3,4-b]indol-9-yl-3-pyridinyl)-4-pyridinyl]-1,10-phenanthroline;9-[5-[2-pyridin-2-yl-6-[10-(trifluoromethyl)phenanthren-2-yl]-4-pyridinyl]-2-pyridinyl]pyrido[2,3-b]indole (CID 161323736) is 5-[5-(4-phenanthren-2-yl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]pyrido[4,3-b]indole;5-[5-(4-phenanthren-2-yl-6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]pyrido[3,2-b]indole;3-[2-pyridin-2-yl-6-(6-pyrido[3,4-b]indol-9-yl-3-pyridinyl)-4-pyridinyl]-1,10-phenanthroline;9-[5-[2-pyridin-2-yl-6-[10-(trifluoromethyl)phenanthren-2-yl]-4-pyridinyl]-2-pyridinyl]pyrido[2,3-b]indole.
What is the SMILES notation for 5-[5-(4-phenanthren-2-yl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]pyrido[4,3-b]indole;5-[5-(4-phenanthren-2-yl-6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]pyrido[3,2-b]indole;3-[2-pyridin-2-yl-6-(6-pyrido[3,4-b]indol-9-yl-3-pyridinyl)-4-pyridinyl]-1,10-phenanthroline;9-[5-[2-pyridin-2-yl-6-[10-(trifluoromethyl)phenanthren-2-yl]-4-pyridinyl]-2-pyridinyl]pyrido[2,3-b]indole?
The canonical SMILES for 5-[5-(4-phenanthren-2-yl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]pyrido[4,3-b]indole;5-[5-(4-phenanthren-2-yl-6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]pyrido[3,2-b]indole;3-[2-pyridin-2-yl-6-(6-pyrido[3,4-b]indol-9-yl-3-pyridinyl)-4-pyridinyl]-1,10-phenanthroline;9-[5-[2-pyridin-2-yl-6-[10-(trifluoromethyl)phenanthren-2-yl]-4-pyridinyl]-2-pyridinyl]pyrido[2,3-b]indole is FC(F)(F)c1cc2ccccc2c2ccc(-c3cc(-c4ccc(-n5c6ccccc6c6cccnc65)nc4)cc(-c4ccccn4)n3)cc12.c1ccc(-c2cc(-c3ccc4c(ccc5ccccc54)c3)cc(-c3ccc(-n4c5ccccc5c5cnccc54)nc3)n2)nc1.c1ccc(-c2cc(-c3cnc4c(ccc5cccnc54)c3)cc(-c3ccc(-n4c5ccccc5c5ccncc54)nc3)n2)nc1.c1cncc(-c2cc(-c3ccc4c(ccc5ccccc54)c3)cc(-c3ccc(-n4c5ccccc5c5ncccc54)nc3)n2)c1.
What is the InChIKey of 5-[5-(4-phenanthren-2-yl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]pyrido[4,3-b]indole;5-[5-(4-phenanthren-2-yl-6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]pyrido[3,2-b]indole;3-[2-pyridin-2-yl-6-(6-pyrido[3,4-b]indol-9-yl-3-pyridinyl)-4-pyridinyl]-1,10-phenanthroline;9-[5-[2-pyridin-2-yl-6-[10-(trifluoromethyl)phenanthren-2-yl]-4-pyridinyl]-2-pyridinyl]pyrido[2,3-b]indole?
The InChIKey is VKMKGJJMZCDXMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H24F3N5.2C40H25N5.C38H23N7/c42-41(43,44)34-21-25-8-1-2-9-29(25)30-16-14-26(20-33(30)34)36-22-28(23-37(48-36)35-12-5-6-18-45-35)27-15-17-39(47-24-27)49-38-13-4-3-10-31(38)32-11-7-19-46-40(32)49;1-2-9-32-26(7-1)13-14-28-21-27(15-17-33(28)32)31-22-35(29-8-5-19-41-24-29)44-36(23-31)30-16-18-39(43-25-30)45-37-11-4-3-10-34(37)40-38(45)12-6-20-42-40;1-2-8-31-26(7-1)12-13-28-21-27(14-16-32(28)31)30-22-36(44-37(23-30)35-10-5-6-19-42-35)29-15-17-40(43-24-29)45-38-11-4-3-9-33(38)34-25-41-20-18-39(34)45;1-2-9-34-29(7-1)30-14-17-39-23-35(30)45(34)36-13-12-26(21-42-36)32-19-27(20-33(44-32)31-8-3-4-15-40-31)28-18-25-11-10-24-6-5-16-41-37(24)38(25)43-22-28/h1-24H;2*1-25H;1-23H.
What are the key properties of 5-[5-(4-phenanthren-2-yl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]pyrido[4,3-b]indole;5-[5-(4-phenanthren-2-yl-6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]pyrido[3,2-b]indole;3-[2-pyridin-2-yl-6-(6-pyrido[3,4-b]indol-9-yl-3-pyridinyl)-4-pyridinyl]-1,10-phenanthroline;9-[5-[2-pyridin-2-yl-6-[10-(trifluoromethyl)phenanthren-2-yl]-4-pyridinyl]-2-pyridinyl]pyrido[2,3-b]indole?
5-[5-(4-phenanthren-2-yl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]pyrido[4,3-b]indole;5-[5-(4-phenanthren-2-yl-6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]pyrido[3,2-b]indole;3-[2-pyridin-2-yl-6-(6-pyrido[3,4-b]indol-9-yl-3-pyridinyl)-4-pyridinyl]-1,10-phenanthroline;9-[5-[2-pyridin-2-yl-6-[10-(trifluoromethyl)phenanthren-2-yl]-4-pyridinyl]-2-pyridinyl]pyrido[2,3-b]indole has a molecular weight of 2372.67 g/mol, XLogP of 38.49, 16 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-(4-phenanthren-2-yl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]pyrido[4,3-b]indole;5-[5-(4-phenanthren-2-yl-6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]pyrido[3,2-b]indole;3-[2-pyridin-2-yl-6-(6-pyrido[3,4-b]indol-9-yl-3-pyridinyl)-4-pyridinyl]-1,10-phenanthroline;9-[5-[2-pyridin-2-yl-6-[10-(trifluoromethyl)phenanthren-2-yl]-4-pyridinyl]-2-pyridinyl]pyrido[2,3-b]indole is sourced from PubChem (CID 161323736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).