2-[4-[4-(2,5-dioxopyrrolidin-1-yl)phenoxy]phenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenoxy]phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[(2,5-dioxopyrrol-1-yl)methyl]-5-[2-[2-[(2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-5-[2-[2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;methane

C174H102F24N16O38S2 — CID 160551653

IUPAC2-[4-[4-(2,5-dioxopyrrolidin-1-yl)phenoxy]phenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenoxy]phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[(2,5-dioxopyrrol-1-yl)methyl]-5-[2-[2-[(2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-5-[2-[2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;methane
SMILESC.C.C.C.O=C1C=CC(=O)N1CN1C(=O)c2ccc(C(c3ccc4c(c3)C(=O)N(CN3C(=O)C=CC3=O)C4=O)(C(F)(F)F)C(F)(F)F)cc2C1=O.O=C1C=CC(=O)N1c1ccc(N2C(=O)c3ccc(C(c4ccc5c(c4)C(=O)N(c4ccc(N6C(=O)C=CC6=O)cc4)C5=O)(C(F)(F)F)C(F)(F)F)cc3C2=O)cc1.O=C1C=CC(=O)N1c1ccc(Oc2ccc(N3C(=O)c4ccc(C(c5ccc6c(c5)C(=O)N(c5ccc(Oc7ccc(N8C(=O)CCC8=O)cc7)cc5)C6=O)(C(F)(F)F)C(F)(F)F)cc4C3=O)cc2)cc1.O=C1C=CC(=O)N1c1ccc(S(=O)(=O)c2ccc(N3C(=O)c4ccc(C(c5ccc6c(c5)C(=O)N(c5ccc(S(=O)(=O)c7ccc(N8C(=O)C=CC8=O)cc7)cc5)C6=O)(C(F)(F)F)C(F)(F)F)cc4C3=O)cc2)cc1
InChIInChI=1S/C51H26F6N4O12S2.C51H28F6N4O10.C39H18F6N4O8.C29H14F6N4O8.4CH4/c52-50(53,54)49(51(55,56)57,27-1-19-37-39(25-27)47(68)60(45(37)66)31-7-15-35(16-8-31)74(70,71)33-11-3-29(4-12-33)58-41(62)21-22-42(58)63)28-2-20-38-40(26-28)48(69)61(46(38)67)32-9-17-36(18-10-32)75(72,73)34-13-5-30(6-14-34)59-43(64)23-24-44(59)65;52-50(53,54)49(51(55,56)57,27-1-19-37-39(25-27)47(68)60(45(37)66)31-7-15-35(16-8-31)70-33-11-3-29(4-12-33)58-41(62)21-22-42(58)63)28-2-20-38-40(26-28)48(69)61(46(38)67)32-9-17-36(18-10-32)71-34-13-5-30(6-14-34)59-43(64)23-24-44(59)65;40-38(41,42)37(39(43,44)45,19-1-11-25-27(17-19)35(56)48(33(25)54)23-7-3-21(4-8-23)46-29(50)13-14-30(46)51)20-2-12-26-28(18-20)36(57)49(34(26)55)24-9-5-22(6-10-24)47-31(52)15-16-32(47)53;30-28(31,32)27(29(33,34)35,13-1-3-15-17(9-13)25(46)38(23(15)44)11-36-19(40)5-6-20(36)41)14-2-4-16-18(10-14)26(47)39(24(16)45)12-37-21(42)7-8-22(37)43;;;;/h1-26H;1-22,25-26H,23-24H2;1-18H;1-10H,11-12H2;4*1H4
InChIKeyQYDQMWJQCVHBJX-UHFFFAOYSA-N
MW3544.89 g/mol
LogP26.74
Rot. Bonds32

About 2-[4-[4-(2,5-dioxopyrrolidin-1-yl)phenoxy]phenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenoxy]phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[(2,5-dioxopyrrol-1-yl)methyl]-5-[2-[2-[(2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-5-[2-[2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;methane

2-[4-[4-(2,5-dioxopyrrolidin-1-yl)phenoxy]phenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenoxy]phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[(2,5-dioxopyrrol-1-yl)methyl]-5-[2-[2-[(2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-5-[2-[2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;methane (PubChem CID 160551653) has the molecular formula C174H102F24N16O38S2 and a molecular weight of 3544.89 g/mol. Its IUPAC name is 2-[4-[4-(2,5-dioxopyrrolidin-1-yl)phenoxy]phenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenoxy]phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[(2,5-dioxopyrrol-1-yl)methyl]-5-[2-[2-[(2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-5-[2-[2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;methane.

Molecular Properties

Compound Name2-[4-[4-(2,5-dioxopyrrolidin-1-yl)phenoxy]phenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenoxy]phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[(2,5-dioxopyrrol-1-yl)methyl]-5-[2-[2-[(2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-5-[2-[2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;methane
PubChem CID160551653
Molecular FormulaC174H102F24N16O38S2
Molecular Weight3544.89 g/mol
Exact Mass3542.56
IUPAC Name2-[4-[4-(2,5-dioxopyrrolidin-1-yl)phenoxy]phenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenoxy]phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[(2,5-dioxopyrrol-1-yl)methyl]-5-[2-[2-[(2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-5-[2-[2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;methane
SMILESC.C.C.C.O=C1C=CC(=O)N1CN1C(=O)c2ccc(C(c3ccc4c(c3)C(=O)N(CN3C(=O)C=CC3=O)C4=O)(C(F)(F)F)C(F)(F)F)cc2C1=O.O=C1C=CC(=O)N1c1ccc(N2C(=O)c3ccc(C(c4ccc5c(c4)C(=O)N(c4ccc(N6C(=O)C=CC6=O)cc4)C5=O)(C(F)(F)F)C(F)(F)F)cc3C2=O)cc1.O=C1C=CC(=O)N1c1ccc(Oc2ccc(N3C(=O)c4ccc(C(c5ccc6c(c5)C(=O)N(c5ccc(Oc7ccc(N8C(=O)CCC8=O)cc7)cc5)C6=O)(C(F)(F)F)C(F)(F)F)cc4C3=O)cc2)cc1.O=C1C=CC(=O)N1c1ccc(S(=O)(=O)c2ccc(N3C(=O)c4ccc(C(c5ccc6c(c5)C(=O)N(c5ccc(S(=O)(=O)c7ccc(N8C(=O)C=CC8=O)cc7)cc5)C6=O)(C(F)(F)F)C(F)(F)F)cc4C3=O)cc2)cc1
InChIInChI=1S/C51H26F6N4O12S2.C51H28F6N4O10.C39H18F6N4O8.C29H14F6N4O8.4CH4/c52-50(53,54)49(51(55,56)57,27-1-19-37-39(25-27)47(68)60(45(37)66)31-7-15-35(16-8-31)74(70,71)33-11-3-29(4-12-33)58-41(62)21-22-42(58)63)28-2-20-38-40(26-28)48(69)61(46(38)67)32-9-17-36(18-10-32)75(72,73)34-13-5-30(6-14-34)59-43(64)23-24-44(59)65;52-50(53,54)49(51(55,56)57,27-1-19-37-39(25-27)47(68)60(45(37)66)31-7-15-35(16-8-31)70-33-11-3-29(4-12-33)58-41(62)21-22-42(58)63)28-2-20-38-40(26-28)48(69)61(46(38)67)32-9-17-36(18-10-32)71-34-13-5-30(6-14-34)59-43(64)23-24-44(59)65;40-38(41,42)37(39(43,44)45,19-1-11-25-27(17-19)35(56)48(33(25)54)23-7-3-21(4-8-23)46-29(50)13-14-30(46)51)20-2-12-26-28(18-20)36(57)49(34(26)55)24-9-5-22(6-10-24)47-31(52)15-16-32(47)53;30-28(31,32)27(29(33,34)35,13-1-3-15-17(9-13)25(46)38(23(15)44)11-36-19(40)5-6-20(36)41)14-2-4-16-18(10-14)26(47)39(24(16)45)12-37-21(42)7-8-22(37)43;;;;/h1-26H;1-22,25-26H,23-24H2;1-18H;1-10H,11-12H2;4*1H4
InChIKeyQYDQMWJQCVHBJX-UHFFFAOYSA-N
XLogP26.74
TPSA684.82 Ų
H-Bond Donors
H-Bond Acceptors38
Rotatable Bonds32
Heavy Atoms254
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003544.89
LogP ≤ 526.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1038

Analyze 2-[4-[4-(2,5-dioxopyrrolidin-1-yl)phenoxy]phenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenoxy]phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[(2,5-dioxopyrrol-1-yl)methyl]-5-[2-[2-[(2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-5-[2-[2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;methane with MolForge

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Related Compounds

5-[2-[2-[5-[3-[1,3-Dioxo-5-[1,1,1-trifluoro-2-[2-[4-(4-methylphenoxy)phenyl]-1,3-dioxoisoindol-5-yl]propan-2-yl]isoindol-2-yl]-4-hydroxyphenyl]sulfonyl-2-hydroxyphenyl]-1,3-dioxoisoindol-5-yl]-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione
CID 58177588
2-[[3-Ethyl-4-(4-ethyl-1-methyl-2,5-dioxopyrrolidin-3-yl)-2,5-dioxopyrrolidin-1-yl]methyl]-5-[2-[2-[4-[4-[3-ethyl-4-(4-ethyl-1-methyl-2,5-dioxopyrrolidin-3-yl)-2,5-dioxopyrrolidin-1-yl]phenoxy]phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione
CID 60138653
5-[1,1,1,3,3,3-Hexafluoro-2-[2-[4-(4-methylphenoxy)phenyl]-1,3-dioxoisoindol-5-yl]propan-2-yl]-2-methylisoindole-1,3-dione;2-methyl-5-[[2-[4-(4-methylphenoxy)phenyl]-1,3-dioxoisoindol-5-yl]methyl]isoindole-1,3-dione
CID 90770337
5-[2-[2-[4-[3-[3-(3-Aminophenoxy)phenyl]sulfonylphenoxy]phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-methylisoindole-1,3-dione
CID 138534689
CID 157239428
CID 157239428
CID 157564010
CID 157564010
5-(2-Butyl-1,3-dioxoisoindol-5-yl)-2-methylisoindole-1,3-dione;5-[2-(2-butyl-1,3-dioxoisoindol-5-yl)-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione;2-butyl-6-methyl-4,8-bis(trifluoromethyl)pyrrolo[3,4-f]isoindole-1,3,5,7-tetrone;5-[1,1,1,3,3,3-hexafluoro-2-[2-[4-(4-methylphenoxy)phenyl]-1,3-dioxoisoindol-5-yl]propan-2-yl]-2-methylisoindole-1,3-dione;methane
CID 157566731
5-(2-Butyl-1,3-dioxoisoindol-5-yl)-2-methylisoindole-1,3-dione;5-[2-(2-butyl-1,3-dioxoisoindol-5-yl)-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione;2-butyl-6-methyl-4,8-bis(trifluoromethyl)pyrrolo[3,4-f]isoindole-1,3,5,7-tetrone;5-[1,1,1,3,3,3-hexafluoro-2-[2-[4-(4-methylphenoxy)phenyl]-1,3-dioxoisoindol-5-yl]propan-2-yl]-2-methylisoindole-1,3-dione;methane
CID 157935979
CID 158221493
CID 158221493
Bis(4-phenoxyphenyl)methanone;5-[1,3-dioxo-2-(4-phenoxyphenyl)isoindole-5-carbonyl]-2-(4-phenoxyphenyl)isoindole-1,3-dione;5-[2-[1,3-dioxo-2-(4-phenoxyphenyl)isoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-(4-phenoxyphenyl)isoindole-1,3-dione;5-[1,3-dioxo-2-(4-phenoxyphenyl)isoindol-5-yl]oxy-2-(4-phenoxyphenyl)isoindole-1,3-dione;5-[1,3-dioxo-2-(4-phenoxyphenyl)isoindol-5-yl]-2-(4-phenoxyphenyl)isoindole-1,3-dione;5-[1,3-dioxo-2-(4-phenoxyphenyl)isoindol-5-yl]sulfonyl-2-(4-phenoxyphenyl)isoindole-1,3-dione;[4-(4-phenoxybenzoyl)phenyl]-(4-phenoxyphenyl)methanone;1-phenoxy-4-(4-phenoxyphenyl)sulfonylbenzene
CID 158692870
5-(2-Butyl-1,3-dioxoisoindol-5-yl)-2-methylisoindole-1,3-dione;5-[2-(2-butyl-1,3-dioxoisoindol-5-yl)-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione;2-butyl-6-methyl-4,8-bis(trifluoromethyl)pyrrolo[3,4-f]isoindole-1,3,5,7-tetrone;5-[1,1,1,3,3,3-hexafluoro-2-[2-[4-(4-methylphenoxy)phenyl]-1,3-dioxoisoindol-5-yl]propan-2-yl]-2-methylisoindole-1,3-dione
CID 158769460
CID 158799208
CID 158799208

Frequently Asked Questions

What is the IUPAC name of 2-[4-[4-(2,5-dioxopyrrolidin-1-yl)phenoxy]phenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenoxy]phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[(2,5-dioxopyrrol-1-yl)methyl]-5-[2-[2-[(2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-5-[2-[2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;methane?
The IUPAC name of 2-[4-[4-(2,5-dioxopyrrolidin-1-yl)phenoxy]phenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenoxy]phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[(2,5-dioxopyrrol-1-yl)methyl]-5-[2-[2-[(2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-5-[2-[2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;methane (CID 160551653) is 2-[4-[4-(2,5-dioxopyrrolidin-1-yl)phenoxy]phenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenoxy]phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[(2,5-dioxopyrrol-1-yl)methyl]-5-[2-[2-[(2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-5-[2-[2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;methane.
What is the SMILES notation for 2-[4-[4-(2,5-dioxopyrrolidin-1-yl)phenoxy]phenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenoxy]phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[(2,5-dioxopyrrol-1-yl)methyl]-5-[2-[2-[(2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-5-[2-[2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;methane?
The canonical SMILES for 2-[4-[4-(2,5-dioxopyrrolidin-1-yl)phenoxy]phenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenoxy]phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[(2,5-dioxopyrrol-1-yl)methyl]-5-[2-[2-[(2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-5-[2-[2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;methane is C.C.C.C.O=C1C=CC(=O)N1CN1C(=O)c2ccc(C(c3ccc4c(c3)C(=O)N(CN3C(=O)C=CC3=O)C4=O)(C(F)(F)F)C(F)(F)F)cc2C1=O.O=C1C=CC(=O)N1c1ccc(N2C(=O)c3ccc(C(c4ccc5c(c4)C(=O)N(c4ccc(N6C(=O)C=CC6=O)cc4)C5=O)(C(F)(F)F)C(F)(F)F)cc3C2=O)cc1.O=C1C=CC(=O)N1c1ccc(Oc2ccc(N3C(=O)c4ccc(C(c5ccc6c(c5)C(=O)N(c5ccc(Oc7ccc(N8C(=O)CCC8=O)cc7)cc5)C6=O)(C(F)(F)F)C(F)(F)F)cc4C3=O)cc2)cc1.O=C1C=CC(=O)N1c1ccc(S(=O)(=O)c2ccc(N3C(=O)c4ccc(C(c5ccc6c(c5)C(=O)N(c5ccc(S(=O)(=O)c7ccc(N8C(=O)C=CC8=O)cc7)cc5)C6=O)(C(F)(F)F)C(F)(F)F)cc4C3=O)cc2)cc1.
What is the InChIKey of 2-[4-[4-(2,5-dioxopyrrolidin-1-yl)phenoxy]phenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenoxy]phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[(2,5-dioxopyrrol-1-yl)methyl]-5-[2-[2-[(2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-5-[2-[2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;methane?
The InChIKey is QYDQMWJQCVHBJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H26F6N4O12S2.C51H28F6N4O10.C39H18F6N4O8.C29H14F6N4O8.4CH4/c52-50(53,54)49(51(55,56)57,27-1-19-37-39(25-27)47(68)60(45(37)66)31-7-15-35(16-8-31)74(70,71)33-11-3-29(4-12-33)58-41(62)21-22-42(58)63)28-2-20-38-40(26-28)48(69)61(46(38)67)32-9-17-36(18-10-32)75(72,73)34-13-5-30(6-14-34)59-43(64)23-24-44(59)65;52-50(53,54)49(51(55,56)57,27-1-19-37-39(25-27)47(68)60(45(37)66)31-7-15-35(16-8-31)70-33-11-3-29(4-12-33)58-41(62)21-22-42(58)63)28-2-20-38-40(26-28)48(69)61(46(38)67)32-9-17-36(18-10-32)71-34-13-5-30(6-14-34)59-43(64)23-24-44(59)65;40-38(41,42)37(39(43,44)45,19-1-11-25-27(17-19)35(56)48(33(25)54)23-7-3-21(4-8-23)46-29(50)13-14-30(46)51)20-2-12-26-28(18-20)36(57)49(34(26)55)24-9-5-22(6-10-24)47-31(52)15-16-32(47)53;30-28(31,32)27(29(33,34)35,13-1-3-15-17(9-13)25(46)38(23(15)44)11-36-19(40)5-6-20(36)41)14-2-4-16-18(10-14)26(47)39(24(16)45)12-37-21(42)7-8-22(37)43;;;;/h1-26H;1-22,25-26H,23-24H2;1-18H;1-10H,11-12H2;4*1H4.
What are the key properties of 2-[4-[4-(2,5-dioxopyrrolidin-1-yl)phenoxy]phenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenoxy]phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[(2,5-dioxopyrrol-1-yl)methyl]-5-[2-[2-[(2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-5-[2-[2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;methane?
2-[4-[4-(2,5-dioxopyrrolidin-1-yl)phenoxy]phenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenoxy]phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[(2,5-dioxopyrrol-1-yl)methyl]-5-[2-[2-[(2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-5-[2-[2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;methane has a molecular weight of 3544.89 g/mol, XLogP of 26.74, 32 rotatable bonds, 0 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[4-(2,5-dioxopyrrolidin-1-yl)phenoxy]phenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenoxy]phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[(2,5-dioxopyrrol-1-yl)methyl]-5-[2-[2-[(2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-5-[2-[2-[4-(2,5-dioxopyrrol-1-yl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-5-[2-[2-[4-[4-(2,5-dioxopyrrol-1-yl)phenyl]sulfonylphenyl]-1,3-dioxoisoindol-5-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]isoindole-1,3-dione;methane is sourced from PubChem (CID 160551653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).