3-[3-[2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[4-(trifluoromethyl)-3-pyridinyl]phenyl]phenyl]-4-methylphenyl]-4-methylpyridine;4-methyl-3-[4-methyl-3-[4-[2-methyl-5-(4-methyl-3-pyridinyl)phenyl]-2,5-bis(2-methylphenyl)phenyl]phenyl]pyridine;1-[2-methyl-5-(2-methylphenyl)phenyl]-2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[2-(trifluoromethyl)phenyl]phenyl]benzene

C140H110F12N4 — CID 90917236

IUPAC3-[3-[2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[4-(trifluoromethyl)-3-pyridinyl]phenyl]phenyl]-4-methylphenyl]-4-methylpyridine;4-methyl-3-[4-methyl-3-[4-[2-methyl-5-(4-methyl-3-pyridinyl)phenyl]-2,5-bis(2-methylphenyl)phenyl]phenyl]pyridine;1-[2-methyl-5-(2-methylphenyl)phenyl]-2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[2-(trifluoromethyl)phenyl]phenyl]benzene
SMILESCc1ccccc1-c1ccc(C)c(-c2cc(-c3ccccc3C)c(-c3cc(-c4ccccc4C(F)(F)F)ccc3C(F)(F)F)cc2-c2ccccc2C)c1.Cc1ccncc1-c1ccc(C)c(-c2cc(-c3ccccc3C)c(-c3cc(-c4cnccc4C(F)(F)F)ccc3C(F)(F)F)cc2-c2ccccc2C)c1.Cc1ccncc1-c1ccc(C)c(-c2cc(-c3ccccc3C)c(-c3cc(-c4cnccc4C)ccc3C)cc2-c2ccccc2C)c1
InChIInChI=1S/C48H36F6.C46H34F6N2.C46H40N2/c1-29-13-5-8-16-35(29)33-22-21-32(4)39(25-33)42-27-41(37-18-10-7-15-31(37)3)43(28-40(42)36-17-9-6-14-30(36)2)44-26-34(23-24-46(44)48(52,53)54)38-19-11-12-20-45(38)47(49,50)51;1-27-9-5-7-11-33(27)36-24-39(40-22-32(15-16-43(40)45(47,48)49)42-26-54-20-18-44(42)46(50,51)52)37(34-12-8-6-10-28(34)2)23-38(36)35-21-31(14-13-29(35)3)41-25-53-19-17-30(41)4;1-29-11-7-9-13-37(29)41-25-44(40-24-36(18-16-32(40)4)46-28-48-22-20-34(46)6)42(38-14-10-8-12-30(38)2)26-43(41)39-23-35(17-15-31(39)3)45-27-47-21-19-33(45)5/h5-28H,1-4H3;5-26H,1-4H3;7-28H,1-6H3
InChIKeyZPJWLYINSMIFSW-UHFFFAOYSA-N
MW2076.42 g/mol
LogP41.04
Rot. Bonds18

About 3-[3-[2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[4-(trifluoromethyl)-3-pyridinyl]phenyl]phenyl]-4-methylphenyl]-4-methylpyridine;4-methyl-3-[4-methyl-3-[4-[2-methyl-5-(4-methyl-3-pyridinyl)phenyl]-2,5-bis(2-methylphenyl)phenyl]phenyl]pyridine;1-[2-methyl-5-(2-methylphenyl)phenyl]-2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[2-(trifluoromethyl)phenyl]phenyl]benzene

3-[3-[2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[4-(trifluoromethyl)-3-pyridinyl]phenyl]phenyl]-4-methylphenyl]-4-methylpyridine;4-methyl-3-[4-methyl-3-[4-[2-methyl-5-(4-methyl-3-pyridinyl)phenyl]-2,5-bis(2-methylphenyl)phenyl]phenyl]pyridine;1-[2-methyl-5-(2-methylphenyl)phenyl]-2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[2-(trifluoromethyl)phenyl]phenyl]benzene (PubChem CID 90917236) has the molecular formula C140H110F12N4 and a molecular weight of 2076.42 g/mol. Its IUPAC name is 3-[3-[2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[4-(trifluoromethyl)-3-pyridinyl]phenyl]phenyl]-4-methylphenyl]-4-methylpyridine;4-methyl-3-[4-methyl-3-[4-[2-methyl-5-(4-methyl-3-pyridinyl)phenyl]-2,5-bis(2-methylphenyl)phenyl]phenyl]pyridine;1-[2-methyl-5-(2-methylphenyl)phenyl]-2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[2-(trifluoromethyl)phenyl]phenyl]benzene.

Molecular Properties

Compound Name3-[3-[2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[4-(trifluoromethyl)-3-pyridinyl]phenyl]phenyl]-4-methylphenyl]-4-methylpyridine;4-methyl-3-[4-methyl-3-[4-[2-methyl-5-(4-methyl-3-pyridinyl)phenyl]-2,5-bis(2-methylphenyl)phenyl]phenyl]pyridine;1-[2-methyl-5-(2-methylphenyl)phenyl]-2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[2-(trifluoromethyl)phenyl]phenyl]benzene
PubChem CID90917236
Molecular FormulaC140H110F12N4
Molecular Weight2076.42 g/mol
Exact Mass2074.85
IUPAC Name3-[3-[2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[4-(trifluoromethyl)-3-pyridinyl]phenyl]phenyl]-4-methylphenyl]-4-methylpyridine;4-methyl-3-[4-methyl-3-[4-[2-methyl-5-(4-methyl-3-pyridinyl)phenyl]-2,5-bis(2-methylphenyl)phenyl]phenyl]pyridine;1-[2-methyl-5-(2-methylphenyl)phenyl]-2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[2-(trifluoromethyl)phenyl]phenyl]benzene
SMILESCc1ccccc1-c1ccc(C)c(-c2cc(-c3ccccc3C)c(-c3cc(-c4ccccc4C(F)(F)F)ccc3C(F)(F)F)cc2-c2ccccc2C)c1.Cc1ccncc1-c1ccc(C)c(-c2cc(-c3ccccc3C)c(-c3cc(-c4cnccc4C(F)(F)F)ccc3C(F)(F)F)cc2-c2ccccc2C)c1.Cc1ccncc1-c1ccc(C)c(-c2cc(-c3ccccc3C)c(-c3cc(-c4cnccc4C)ccc3C)cc2-c2ccccc2C)c1
InChIInChI=1S/C48H36F6.C46H34F6N2.C46H40N2/c1-29-13-5-8-16-35(29)33-22-21-32(4)39(25-33)42-27-41(37-18-10-7-15-31(37)3)43(28-40(42)36-17-9-6-14-30(36)2)44-26-34(23-24-46(44)48(52,53)54)38-19-11-12-20-45(38)47(49,50)51;1-27-9-5-7-11-33(27)36-24-39(40-22-32(15-16-43(40)45(47,48)49)42-26-54-20-18-44(42)46(50,51)52)37(34-12-8-6-10-28(34)2)23-38(36)35-21-31(14-13-29(35)3)41-25-53-19-17-30(41)4;1-29-11-7-9-13-37(29)41-25-44(40-24-36(18-16-32(40)4)46-28-48-22-20-34(46)6)42(38-14-10-8-12-30(38)2)26-43(41)39-23-35(17-15-31(39)3)45-27-47-21-19-33(45)5/h5-28H,1-4H3;5-26H,1-4H3;7-28H,1-6H3
InChIKeyZPJWLYINSMIFSW-UHFFFAOYSA-N
XLogP41.04
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds18
Heavy Atoms156
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002076.42
LogP ≤ 541.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-[3-[2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[4-(trifluoromethyl)-3-pyridinyl]phenyl]phenyl]-4-methylphenyl]-4-methylpyridine;4-methyl-3-[4-methyl-3-[4-[2-methyl-5-(4-methyl-3-pyridinyl)phenyl]-2,5-bis(2-methylphenyl)phenyl]phenyl]pyridine;1-[2-methyl-5-(2-methylphenyl)phenyl]-2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[2-(trifluoromethyl)phenyl]phenyl]benzene with MolForge

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Related Compounds

1-[5-[3,5-Bis[5-(3-phenylpyridin-1-ium-1-yl)pentyl]phenyl]pentyl]-3-phenylpyridin-1-ium tribromide
CID 23729443
3-Phenyl-1-[5-[2,4,5-tris[5-(3-phenylpyridin-1-ium-1-yl)pent-1-ynyl]phenyl]pent-4-ynyl]pyridin-1-ium tetrabromide
CID 44158944
3-Benzyl-1-[5-[2,4,5-tris[5-(3-benzylpyridin-1-ium-1-yl)pentyl]phenyl]pentyl]pyridin-1-ium tetrabromide
CID 44159304
2-[5-[2,4,5-Tris(5-isoquinolin-2-ium-2-ylpentyl)phenyl]pentyl]isoquinolin-2-ium tetrabromide
CID 44159419
3-Phenyl-1-[5-[2,4,5-tris[5-(3-phenylpyridin-1-ium-1-yl)pentyl]phenyl]pentyl]pyridin-1-ium tetrabromide
CID 44159538
Isoquinolinium, 2,2a(2),2a(2)a(2)-(1,3,5-benzenetriyltri-5,1-pentanediyl)tris-, bromide (1:3)
CID 23729447
1-[[3,5-Bis[[4-(1-ethylpyridin-1-ium-4-yl)pyridin-1-ium-1-yl]methyl]phenyl]methyl]-4-[1-[[3-[[4-[4-[[3,5-bis[[4-(1-ethylpyridin-1-ium-4-yl)pyridin-1-ium-1-yl]methyl]phenyl]methyl]phenyl]pyridin-1-ium-1-yl]methyl]-5-[[4-[1-[[3,5-bis[[4-(1-ethylpyridin-1-ium-4-yl)pyridin-1-ium-1-yl]methyl]phenyl]methyl]pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]methyl]phenyl]methyl]pyridin-1-ium-4-yl]pyridin-1-ium heptadecahexafluorophosphate
CID 46889633
1-[3,5-Bis[[4-[1-[[3,5-bis[[4-(1-ethylpyridin-1-ium-4-yl)pyridin-1-ium-1-yl]methyl]phenyl]methyl]pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]methyl]phenyl]-4-[1-[3,5-bis[[4-[1-[[3,5-bis[[4-(1-ethylpyridin-1-ium-4-yl)pyridin-1-ium-1-yl]methyl]phenyl]methyl]pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]methyl]phenyl]pyridin-1-ium-4-yl]pyridin-1-ium hexacosahexafluorophosphate
CID 46889635
3-[2-[4-Fluoro-2-[3-(trifluoromethyl)phenyl]phenyl]-1-pyridin-3-ylethyl]pyridine
CID 67264841
(E)-4-(3-fluoro-5-(4-(pyridin-4-yl)styryl)phenyl)pyridine
CID 121481848
4-(3-Fluoro-5-(4-(pyridin-4-yl)phenethyl)phenyl)pyridine
CID 121481872
Cyclobis(paraquat-1,4-phenylene) Tetrakis(hexafluorophosphate)
CID 11040455

Frequently Asked Questions

What is the IUPAC name of 3-[3-[2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[4-(trifluoromethyl)-3-pyridinyl]phenyl]phenyl]-4-methylphenyl]-4-methylpyridine;4-methyl-3-[4-methyl-3-[4-[2-methyl-5-(4-methyl-3-pyridinyl)phenyl]-2,5-bis(2-methylphenyl)phenyl]phenyl]pyridine;1-[2-methyl-5-(2-methylphenyl)phenyl]-2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[2-(trifluoromethyl)phenyl]phenyl]benzene?
The IUPAC name of 3-[3-[2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[4-(trifluoromethyl)-3-pyridinyl]phenyl]phenyl]-4-methylphenyl]-4-methylpyridine;4-methyl-3-[4-methyl-3-[4-[2-methyl-5-(4-methyl-3-pyridinyl)phenyl]-2,5-bis(2-methylphenyl)phenyl]phenyl]pyridine;1-[2-methyl-5-(2-methylphenyl)phenyl]-2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[2-(trifluoromethyl)phenyl]phenyl]benzene (CID 90917236) is 3-[3-[2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[4-(trifluoromethyl)-3-pyridinyl]phenyl]phenyl]-4-methylphenyl]-4-methylpyridine;4-methyl-3-[4-methyl-3-[4-[2-methyl-5-(4-methyl-3-pyridinyl)phenyl]-2,5-bis(2-methylphenyl)phenyl]phenyl]pyridine;1-[2-methyl-5-(2-methylphenyl)phenyl]-2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[2-(trifluoromethyl)phenyl]phenyl]benzene.
What is the SMILES notation for 3-[3-[2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[4-(trifluoromethyl)-3-pyridinyl]phenyl]phenyl]-4-methylphenyl]-4-methylpyridine;4-methyl-3-[4-methyl-3-[4-[2-methyl-5-(4-methyl-3-pyridinyl)phenyl]-2,5-bis(2-methylphenyl)phenyl]phenyl]pyridine;1-[2-methyl-5-(2-methylphenyl)phenyl]-2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[2-(trifluoromethyl)phenyl]phenyl]benzene?
The canonical SMILES for 3-[3-[2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[4-(trifluoromethyl)-3-pyridinyl]phenyl]phenyl]-4-methylphenyl]-4-methylpyridine;4-methyl-3-[4-methyl-3-[4-[2-methyl-5-(4-methyl-3-pyridinyl)phenyl]-2,5-bis(2-methylphenyl)phenyl]phenyl]pyridine;1-[2-methyl-5-(2-methylphenyl)phenyl]-2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[2-(trifluoromethyl)phenyl]phenyl]benzene is Cc1ccccc1-c1ccc(C)c(-c2cc(-c3ccccc3C)c(-c3cc(-c4ccccc4C(F)(F)F)ccc3C(F)(F)F)cc2-c2ccccc2C)c1.Cc1ccncc1-c1ccc(C)c(-c2cc(-c3ccccc3C)c(-c3cc(-c4cnccc4C(F)(F)F)ccc3C(F)(F)F)cc2-c2ccccc2C)c1.Cc1ccncc1-c1ccc(C)c(-c2cc(-c3ccccc3C)c(-c3cc(-c4cnccc4C)ccc3C)cc2-c2ccccc2C)c1.
What is the InChIKey of 3-[3-[2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[4-(trifluoromethyl)-3-pyridinyl]phenyl]phenyl]-4-methylphenyl]-4-methylpyridine;4-methyl-3-[4-methyl-3-[4-[2-methyl-5-(4-methyl-3-pyridinyl)phenyl]-2,5-bis(2-methylphenyl)phenyl]phenyl]pyridine;1-[2-methyl-5-(2-methylphenyl)phenyl]-2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[2-(trifluoromethyl)phenyl]phenyl]benzene?
The InChIKey is ZPJWLYINSMIFSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H36F6.C46H34F6N2.C46H40N2/c1-29-13-5-8-16-35(29)33-22-21-32(4)39(25-33)42-27-41(37-18-10-7-15-31(37)3)43(28-40(42)36-17-9-6-14-30(36)2)44-26-34(23-24-46(44)48(52,53)54)38-19-11-12-20-45(38)47(49,50)51;1-27-9-5-7-11-33(27)36-24-39(40-22-32(15-16-43(40)45(47,48)49)42-26-54-20-18-44(42)46(50,51)52)37(34-12-8-6-10-28(34)2)23-38(36)35-21-31(14-13-29(35)3)41-25-53-19-17-30(41)4;1-29-11-7-9-13-37(29)41-25-44(40-24-36(18-16-32(40)4)46-28-48-22-20-34(46)6)42(38-14-10-8-12-30(38)2)26-43(41)39-23-35(17-15-31(39)3)45-27-47-21-19-33(45)5/h5-28H,1-4H3;5-26H,1-4H3;7-28H,1-6H3.
What are the key properties of 3-[3-[2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[4-(trifluoromethyl)-3-pyridinyl]phenyl]phenyl]-4-methylphenyl]-4-methylpyridine;4-methyl-3-[4-methyl-3-[4-[2-methyl-5-(4-methyl-3-pyridinyl)phenyl]-2,5-bis(2-methylphenyl)phenyl]phenyl]pyridine;1-[2-methyl-5-(2-methylphenyl)phenyl]-2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[2-(trifluoromethyl)phenyl]phenyl]benzene?
3-[3-[2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[4-(trifluoromethyl)-3-pyridinyl]phenyl]phenyl]-4-methylphenyl]-4-methylpyridine;4-methyl-3-[4-methyl-3-[4-[2-methyl-5-(4-methyl-3-pyridinyl)phenyl]-2,5-bis(2-methylphenyl)phenyl]phenyl]pyridine;1-[2-methyl-5-(2-methylphenyl)phenyl]-2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[2-(trifluoromethyl)phenyl]phenyl]benzene has a molecular weight of 2076.42 g/mol, XLogP of 41.04, 18 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-[2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[4-(trifluoromethyl)-3-pyridinyl]phenyl]phenyl]-4-methylphenyl]-4-methylpyridine;4-methyl-3-[4-methyl-3-[4-[2-methyl-5-(4-methyl-3-pyridinyl)phenyl]-2,5-bis(2-methylphenyl)phenyl]phenyl]pyridine;1-[2-methyl-5-(2-methylphenyl)phenyl]-2,5-bis(2-methylphenyl)-4-[2-(trifluoromethyl)-5-[2-(trifluoromethyl)phenyl]phenyl]benzene is sourced from PubChem (CID 90917236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).