1-[3,5-bis[4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylphenyl]phenyl]-4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylbenzene;2-[3,5-bis(4-phenylquinazolin-2-yl)phenyl]-4-phenylquinazoline;2-[3,5-bis[4-(2,4,6-trifluorophenyl)quinazolin-2-yl]phenyl]-4-(2,4,6-trifluorophenyl)quinazoline

C186H129F9N12 — CID 162007240

IUPAC1-[3,5-bis[4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylphenyl]phenyl]-4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylbenzene;2-[3,5-bis(4-phenylquinazolin-2-yl)phenyl]-4-phenylquinazoline;2-[3,5-bis[4-(2,4,6-trifluorophenyl)quinazolin-2-yl]phenyl]-4-(2,4,6-trifluorophenyl)quinazoline
SMILESCc1c(C)c(-c2cc(-c3c(C)c(C)c(-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)c(C)c3C)cc(-c3c(C)c(C)c(-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)c(C)c3C)c2)c(C)c(C)c1-c1cc(-c2ccccc2)cc(-c2ccccc2)c1.Fc1cc(F)c(-c2nc(-c3cc(-c4nc(-c5c(F)cc(F)cc5F)c5ccccc5n4)cc(-c4nc(-c5c(F)cc(F)cc5F)c5ccccc5n4)c3)nc3ccccc23)c(F)c1.c1ccc(-c2nc(-c3cc(-c4nc(-c5ccccc5)c5ccccc5n4)cc(-c4nc(-c5ccccc5)c5ccccc5n4)c3)nc3ccccc23)cc1
InChIInChI=1S/C90H78.C48H21F9N6.C48H30N6/c1-55-61(7)88(62(8)56(2)85(55)79-46-73(67-31-19-13-20-32-67)43-74(47-79)68-33-21-14-22-34-68)82-52-83(89-63(9)57(3)86(58(4)64(89)10)80-48-75(69-35-23-15-24-36-69)44-76(49-80)70-37-25-16-26-38-70)54-84(53-82)90-65(11)59(5)87(60(6)66(90)12)81-50-77(71-39-27-17-28-40-71)45-78(51-81)72-41-29-18-30-42-72;49-25-16-31(52)40(32(53)17-25)43-28-7-1-4-10-37(28)58-46(61-43)22-13-23(47-59-38-11-5-2-8-29(38)44(62-47)41-33(54)18-26(50)19-34(41)55)15-24(14-22)48-60-39-12-6-3-9-30(39)45(63-48)42-35(56)20-27(51)21-36(42)57;1-4-16-31(17-5-1)43-37-22-10-13-25-40(37)49-46(52-43)34-28-35(47-50-41-26-14-11-23-38(41)44(53-47)32-18-6-2-7-19-32)30-36(29-34)48-51-42-27-15-12-24-39(42)45(54-48)33-20-8-3-9-21-33/h13-54H,1-12H3;1-21H;1-30H
InChIKeyYSZNHYTUCSSQFS-UHFFFAOYSA-N
MW2703.14 g/mol
LogP49.68
Rot. Bonds24

About 1-[3,5-bis[4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylphenyl]phenyl]-4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylbenzene;2-[3,5-bis(4-phenylquinazolin-2-yl)phenyl]-4-phenylquinazoline;2-[3,5-bis[4-(2,4,6-trifluorophenyl)quinazolin-2-yl]phenyl]-4-(2,4,6-trifluorophenyl)quinazoline

1-[3,5-bis[4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylphenyl]phenyl]-4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylbenzene;2-[3,5-bis(4-phenylquinazolin-2-yl)phenyl]-4-phenylquinazoline;2-[3,5-bis[4-(2,4,6-trifluorophenyl)quinazolin-2-yl]phenyl]-4-(2,4,6-trifluorophenyl)quinazoline (PubChem CID 162007240) has the molecular formula C186H129F9N12 and a molecular weight of 2703.14 g/mol. Its IUPAC name is 1-[3,5-bis[4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylphenyl]phenyl]-4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylbenzene;2-[3,5-bis(4-phenylquinazolin-2-yl)phenyl]-4-phenylquinazoline;2-[3,5-bis[4-(2,4,6-trifluorophenyl)quinazolin-2-yl]phenyl]-4-(2,4,6-trifluorophenyl)quinazoline.

Molecular Properties

Compound Name1-[3,5-bis[4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylphenyl]phenyl]-4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylbenzene;2-[3,5-bis(4-phenylquinazolin-2-yl)phenyl]-4-phenylquinazoline;2-[3,5-bis[4-(2,4,6-trifluorophenyl)quinazolin-2-yl]phenyl]-4-(2,4,6-trifluorophenyl)quinazoline
PubChem CID162007240
Molecular FormulaC186H129F9N12
Molecular Weight2703.14 g/mol
Exact Mass2701.03
IUPAC Name1-[3,5-bis[4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylphenyl]phenyl]-4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylbenzene;2-[3,5-bis(4-phenylquinazolin-2-yl)phenyl]-4-phenylquinazoline;2-[3,5-bis[4-(2,4,6-trifluorophenyl)quinazolin-2-yl]phenyl]-4-(2,4,6-trifluorophenyl)quinazoline
SMILESCc1c(C)c(-c2cc(-c3c(C)c(C)c(-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)c(C)c3C)cc(-c3c(C)c(C)c(-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)c(C)c3C)c2)c(C)c(C)c1-c1cc(-c2ccccc2)cc(-c2ccccc2)c1.Fc1cc(F)c(-c2nc(-c3cc(-c4nc(-c5c(F)cc(F)cc5F)c5ccccc5n4)cc(-c4nc(-c5c(F)cc(F)cc5F)c5ccccc5n4)c3)nc3ccccc23)c(F)c1.c1ccc(-c2nc(-c3cc(-c4nc(-c5ccccc5)c5ccccc5n4)cc(-c4nc(-c5ccccc5)c5ccccc5n4)c3)nc3ccccc23)cc1
InChIInChI=1S/C90H78.C48H21F9N6.C48H30N6/c1-55-61(7)88(62(8)56(2)85(55)79-46-73(67-31-19-13-20-32-67)43-74(47-79)68-33-21-14-22-34-68)82-52-83(89-63(9)57(3)86(58(4)64(89)10)80-48-75(69-35-23-15-24-36-69)44-76(49-80)70-37-25-16-26-38-70)54-84(53-82)90-65(11)59(5)87(60(6)66(90)12)81-50-77(71-39-27-17-28-40-71)45-78(51-81)72-41-29-18-30-42-72;49-25-16-31(52)40(32(53)17-25)43-28-7-1-4-10-37(28)58-46(61-43)22-13-23(47-59-38-11-5-2-8-29(38)44(62-47)41-33(54)18-26(50)19-34(41)55)15-24(14-22)48-60-39-12-6-3-9-30(39)45(63-48)42-35(56)20-27(51)21-36(42)57;1-4-16-31(17-5-1)43-37-22-10-13-25-40(37)49-46(52-43)34-28-35(47-50-41-26-14-11-23-38(41)44(53-47)32-18-6-2-7-19-32)30-36(29-34)48-51-42-27-15-12-24-39(42)45(54-48)33-20-8-3-9-21-33/h13-54H,1-12H3;1-21H;1-30H
InChIKeyYSZNHYTUCSSQFS-UHFFFAOYSA-N
XLogP49.68
TPSA154.68 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds24
Heavy Atoms207
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002703.14
LogP ≤ 549.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 1-[3,5-bis[4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylphenyl]phenyl]-4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylbenzene;2-[3,5-bis(4-phenylquinazolin-2-yl)phenyl]-4-phenylquinazoline;2-[3,5-bis[4-(2,4,6-trifluorophenyl)quinazolin-2-yl]phenyl]-4-(2,4,6-trifluorophenyl)quinazoline with MolForge

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Related Compounds

2-(3,5-diphenylphenyl)-4-phenylquinazoline
CID 155283512
2,4-bis(3,5-diphenylphenyl)quinazoline
CID 146334707
4-phenyl-2-[3-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]quinazoline
CID 155156227
2-[4-(4-phenylphenyl)phenyl]-4-[3-[3-[4-[4-(4-phenylphenyl)phenyl]quinazolin-2-yl]phenyl]phenyl]quinazoline
CID 146825143
4-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]-2-phenylquinazoline
CID 126579137
2-phenyl-3-(2,4,6-trifluorophenyl)quinoxaline
CID 71729474
2-[3,5-bis(4-pyridin-2-ylphenyl)phenyl]-4-phenylquinazoline
CID 118552145
6,7-dimethyl-2-phenyl-3-(2,4,6-trifluorophenyl)quinoxaline
CID 71729476
2-(3,5-diphenylphenyl)-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]quinazoline
CID 140796956
4,7-diphenyl-2-[3-(4-phenylphenyl)-5-pyrimidin-2-ylphenyl]quinazoline
CID 144968804
2-[3,5-bis(4,6-diphenyl-2-pyridinyl)phenyl]-4,7-diphenylquinazoline
CID 118552110
4-phenyl-2-[3-[2-[2-[3-(4-phenylquinazolin-2-yl)phenyl]phenyl]phenyl]phenyl]quinazoline
CID 167202663

Frequently Asked Questions

What is the IUPAC name of 1-[3,5-bis[4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylphenyl]phenyl]-4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylbenzene;2-[3,5-bis(4-phenylquinazolin-2-yl)phenyl]-4-phenylquinazoline;2-[3,5-bis[4-(2,4,6-trifluorophenyl)quinazolin-2-yl]phenyl]-4-(2,4,6-trifluorophenyl)quinazoline?
The IUPAC name of 1-[3,5-bis[4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylphenyl]phenyl]-4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylbenzene;2-[3,5-bis(4-phenylquinazolin-2-yl)phenyl]-4-phenylquinazoline;2-[3,5-bis[4-(2,4,6-trifluorophenyl)quinazolin-2-yl]phenyl]-4-(2,4,6-trifluorophenyl)quinazoline (CID 162007240) is 1-[3,5-bis[4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylphenyl]phenyl]-4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylbenzene;2-[3,5-bis(4-phenylquinazolin-2-yl)phenyl]-4-phenylquinazoline;2-[3,5-bis[4-(2,4,6-trifluorophenyl)quinazolin-2-yl]phenyl]-4-(2,4,6-trifluorophenyl)quinazoline.
What is the SMILES notation for 1-[3,5-bis[4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylphenyl]phenyl]-4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylbenzene;2-[3,5-bis(4-phenylquinazolin-2-yl)phenyl]-4-phenylquinazoline;2-[3,5-bis[4-(2,4,6-trifluorophenyl)quinazolin-2-yl]phenyl]-4-(2,4,6-trifluorophenyl)quinazoline?
The canonical SMILES for 1-[3,5-bis[4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylphenyl]phenyl]-4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylbenzene;2-[3,5-bis(4-phenylquinazolin-2-yl)phenyl]-4-phenylquinazoline;2-[3,5-bis[4-(2,4,6-trifluorophenyl)quinazolin-2-yl]phenyl]-4-(2,4,6-trifluorophenyl)quinazoline is Cc1c(C)c(-c2cc(-c3c(C)c(C)c(-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)c(C)c3C)cc(-c3c(C)c(C)c(-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)c(C)c3C)c2)c(C)c(C)c1-c1cc(-c2ccccc2)cc(-c2ccccc2)c1.Fc1cc(F)c(-c2nc(-c3cc(-c4nc(-c5c(F)cc(F)cc5F)c5ccccc5n4)cc(-c4nc(-c5c(F)cc(F)cc5F)c5ccccc5n4)c3)nc3ccccc23)c(F)c1.c1ccc(-c2nc(-c3cc(-c4nc(-c5ccccc5)c5ccccc5n4)cc(-c4nc(-c5ccccc5)c5ccccc5n4)c3)nc3ccccc23)cc1.
What is the InChIKey of 1-[3,5-bis[4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylphenyl]phenyl]-4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylbenzene;2-[3,5-bis(4-phenylquinazolin-2-yl)phenyl]-4-phenylquinazoline;2-[3,5-bis[4-(2,4,6-trifluorophenyl)quinazolin-2-yl]phenyl]-4-(2,4,6-trifluorophenyl)quinazoline?
The InChIKey is YSZNHYTUCSSQFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C90H78.C48H21F9N6.C48H30N6/c1-55-61(7)88(62(8)56(2)85(55)79-46-73(67-31-19-13-20-32-67)43-74(47-79)68-33-21-14-22-34-68)82-52-83(89-63(9)57(3)86(58(4)64(89)10)80-48-75(69-35-23-15-24-36-69)44-76(49-80)70-37-25-16-26-38-70)54-84(53-82)90-65(11)59(5)87(60(6)66(90)12)81-50-77(71-39-27-17-28-40-71)45-78(51-81)72-41-29-18-30-42-72;49-25-16-31(52)40(32(53)17-25)43-28-7-1-4-10-37(28)58-46(61-43)22-13-23(47-59-38-11-5-2-8-29(38)44(62-47)41-33(54)18-26(50)19-34(41)55)15-24(14-22)48-60-39-12-6-3-9-30(39)45(63-48)42-35(56)20-27(51)21-36(42)57;1-4-16-31(17-5-1)43-37-22-10-13-25-40(37)49-46(52-43)34-28-35(47-50-41-26-14-11-23-38(41)44(53-47)32-18-6-2-7-19-32)30-36(29-34)48-51-42-27-15-12-24-39(42)45(54-48)33-20-8-3-9-21-33/h13-54H,1-12H3;1-21H;1-30H.
What are the key properties of 1-[3,5-bis[4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylphenyl]phenyl]-4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylbenzene;2-[3,5-bis(4-phenylquinazolin-2-yl)phenyl]-4-phenylquinazoline;2-[3,5-bis[4-(2,4,6-trifluorophenyl)quinazolin-2-yl]phenyl]-4-(2,4,6-trifluorophenyl)quinazoline?
1-[3,5-bis[4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylphenyl]phenyl]-4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylbenzene;2-[3,5-bis(4-phenylquinazolin-2-yl)phenyl]-4-phenylquinazoline;2-[3,5-bis[4-(2,4,6-trifluorophenyl)quinazolin-2-yl]phenyl]-4-(2,4,6-trifluorophenyl)quinazoline has a molecular weight of 2703.14 g/mol, XLogP of 49.68, 24 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3,5-bis[4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylphenyl]phenyl]-4-(3,5-diphenylphenyl)-2,3,5,6-tetramethylbenzene;2-[3,5-bis(4-phenylquinazolin-2-yl)phenyl]-4-phenylquinazoline;2-[3,5-bis[4-(2,4,6-trifluorophenyl)quinazolin-2-yl]phenyl]-4-(2,4,6-trifluorophenyl)quinazoline is sourced from PubChem (CID 162007240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).