N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3,5-dimethylphenyl]fluoren-9-yl]-2,6-dimethylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3-methylphenyl]fluoren-9-yl]-2-methylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[4-[4-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenoxy]phenyl]sulfonylphenoxy]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenyl]fluoren-9-yl]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;5-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-2-methylisoindole-1,3-dione;5-[2-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione

C308H213F21N20O36S — CID 157239428

IUPACN-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3,5-dimethylphenyl]fluoren-9-yl]-2,6-dimethylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3-methylphenyl]fluoren-9-yl]-2-methylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[4-[4-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenoxy]phenyl]sulfonylphenoxy]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenyl]fluoren-9-yl]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;5-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-2-methylisoindole-1,3-dione;5-[2-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione
SMILESCc1ccc(-c2ccc(N3C(=O)c4ccc(-c5ccc6c(c5)C(=O)N(C)C6=O)cc4C3=O)cc2C(F)(F)F)c(C)c1.Cc1ccc(-c2ccc(N3C(=O)c4ccc(C(=O)Nc5c(C)cc(C6(c7cc(C)c(NC(=O)c8ccc9c(c8)C(=O)N(C)C9=O)c(C)c7)c7ccccc7-c7ccccc76)cc5C)cc4C3=O)cc2C(F)(F)F)c(C)c1.Cc1ccc(-c2ccc(N3C(=O)c4ccc(C(=O)Nc5ccc(C6(c7ccc(NC(=O)c8ccc9c(c8)C(=O)N(C)C9=O)c(C)c7)c7ccccc7-c7ccccc76)cc5C)cc4C3=O)cc2C(F)(F)F)c(C)c1.Cc1ccc(-c2ccc(N3C(=O)c4ccc(C(=O)Nc5ccc(C6(c7ccc(NC(=O)c8ccc9c(c8)C(=O)N(C)C9=O)cc7)c7ccccc7-c7ccccc76)cc5)cc4C3=O)cc2C(F)(F)F)c(C)c1.Cc1ccc(-c2ccc(N3C(=O)c4ccc(C(=O)Nc5ccc(Oc6ccc(S(=O)(=O)c7ccc(Oc8ccc(NC(=O)c9ccc%10c(c9)C(=O)N(C)C%10=O)cc8)cc7)cc6)cc5)cc4C3=O)cc2C(F)(F)F)c(C)c1.Cc1ccc(-c2ccc(N3C(=O)c4ccc(C(C)(c5ccc6c(c5)C(=O)N(C)C6=O)C(F)(F)F)cc4C3=O)cc2C(F)(F)F)c(C)c1
InChIInChI=1S/C63H47F3N4O6.C61H43F3N4O6.C59H39F3N4O6.C58H39F3N4O10S.C35H24F6N2O4.C32H21F3N2O4/c1-32-16-20-43(33(2)24-32)46-23-19-42(31-53(46)63(64,65)66)70-60(75)48-22-18-39(30-50(48)61(70)76)57(72)68-55-36(5)27-41(28-37(55)6)62(51-14-10-8-12-44(51)45-13-9-11-15-52(45)62)40-25-34(3)54(35(4)26-40)67-56(71)38-17-21-47-49(29-38)59(74)69(7)58(47)73;1-32-14-20-41(33(2)26-32)44-23-19-40(31-51(44)61(62,63)64)68-58(73)46-22-16-37(30-48(46)59(68)74)55(70)66-53-25-18-39(28-35(53)4)60(49-12-8-6-10-42(49)43-11-7-9-13-50(43)60)38-17-24-52(34(3)27-38)65-54(69)36-15-21-45-47(29-36)57(72)67(5)56(45)71;1-32-12-24-41(33(2)28-32)44-27-23-40(31-51(44)59(60,61)62)66-56(71)46-26-14-35(30-48(46)57(66)72)53(68)64-39-21-17-37(18-22-39)58(49-10-6-4-8-42(49)43-9-5-7-11-50(43)58)36-15-19-38(20-16-36)63-52(67)34-13-25-45-47(29-34)55(70)65(3)54(45)69;1-32-4-24-45(33(2)28-32)46-27-11-38(31-51(46)58(59,60)61)65-56(70)48-26-6-35(30-50(48)57(65)71)53(67)63-37-9-14-40(15-10-37)75-42-18-22-44(23-19-42)76(72,73)43-20-16-41(17-21-43)74-39-12-7-36(8-13-39)62-52(66)34-5-25-47-49(29-34)55(69)64(3)54(47)68;1-17-5-9-22(18(2)13-17)23-12-8-21(16-28(23)34(36,37)38)43-31(46)25-11-7-20(15-27(25)32(43)47)33(3,35(39,40)41)19-6-10-24-26(14-19)30(45)42(4)29(24)44;1-16-4-8-21(17(2)12-16)22-11-7-20(15-27(22)32(33,34)35)37-30(40)24-10-6-19(14-26(24)31(37)41)18-5-9-23-25(13-18)29(39)36(3)28(23)38/h8-31H,1-7H3,(H,67,71)(H,68,72);6-31H,1-5H3,(H,65,69)(H,66,70);4-31H,1-3H3,(H,63,67)(H,64,68);4-31H,1-3H3,(H,62,66)(H,63,67);5-16H,1-4H3;4-15H,1-3H3
InChIKeyAVAKYHWTANDEJA-UHFFFAOYSA-N
MW5201.22 g/mol
LogP64.00
Rot. Bonds43

About N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3,5-dimethylphenyl]fluoren-9-yl]-2,6-dimethylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3-methylphenyl]fluoren-9-yl]-2-methylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[4-[4-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenoxy]phenyl]sulfonylphenoxy]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenyl]fluoren-9-yl]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;5-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-2-methylisoindole-1,3-dione;5-[2-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione

N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3,5-dimethylphenyl]fluoren-9-yl]-2,6-dimethylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3-methylphenyl]fluoren-9-yl]-2-methylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[4-[4-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenoxy]phenyl]sulfonylphenoxy]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenyl]fluoren-9-yl]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;5-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-2-methylisoindole-1,3-dione;5-[2-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione (PubChem CID 157239428) has the molecular formula C308H213F21N20O36S and a molecular weight of 5201.22 g/mol. Its IUPAC name is N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3,5-dimethylphenyl]fluoren-9-yl]-2,6-dimethylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3-methylphenyl]fluoren-9-yl]-2-methylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[4-[4-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenoxy]phenyl]sulfonylphenoxy]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenyl]fluoren-9-yl]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;5-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-2-methylisoindole-1,3-dione;5-[2-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione.

Molecular Properties

Compound NameN-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3,5-dimethylphenyl]fluoren-9-yl]-2,6-dimethylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3-methylphenyl]fluoren-9-yl]-2-methylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[4-[4-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenoxy]phenyl]sulfonylphenoxy]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenyl]fluoren-9-yl]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;5-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-2-methylisoindole-1,3-dione;5-[2-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione
PubChem CID157239428
Molecular FormulaC308H213F21N20O36S
Molecular Weight5201.22 g/mol
Exact Mass5197.48
IUPAC NameN-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3,5-dimethylphenyl]fluoren-9-yl]-2,6-dimethylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3-methylphenyl]fluoren-9-yl]-2-methylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[4-[4-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenoxy]phenyl]sulfonylphenoxy]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenyl]fluoren-9-yl]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;5-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-2-methylisoindole-1,3-dione;5-[2-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione
SMILESCc1ccc(-c2ccc(N3C(=O)c4ccc(-c5ccc6c(c5)C(=O)N(C)C6=O)cc4C3=O)cc2C(F)(F)F)c(C)c1.Cc1ccc(-c2ccc(N3C(=O)c4ccc(C(=O)Nc5c(C)cc(C6(c7cc(C)c(NC(=O)c8ccc9c(c8)C(=O)N(C)C9=O)c(C)c7)c7ccccc7-c7ccccc76)cc5C)cc4C3=O)cc2C(F)(F)F)c(C)c1.Cc1ccc(-c2ccc(N3C(=O)c4ccc(C(=O)Nc5ccc(C6(c7ccc(NC(=O)c8ccc9c(c8)C(=O)N(C)C9=O)c(C)c7)c7ccccc7-c7ccccc76)cc5C)cc4C3=O)cc2C(F)(F)F)c(C)c1.Cc1ccc(-c2ccc(N3C(=O)c4ccc(C(=O)Nc5ccc(C6(c7ccc(NC(=O)c8ccc9c(c8)C(=O)N(C)C9=O)cc7)c7ccccc7-c7ccccc76)cc5)cc4C3=O)cc2C(F)(F)F)c(C)c1.Cc1ccc(-c2ccc(N3C(=O)c4ccc(C(=O)Nc5ccc(Oc6ccc(S(=O)(=O)c7ccc(Oc8ccc(NC(=O)c9ccc%10c(c9)C(=O)N(C)C%10=O)cc8)cc7)cc6)cc5)cc4C3=O)cc2C(F)(F)F)c(C)c1.Cc1ccc(-c2ccc(N3C(=O)c4ccc(C(C)(c5ccc6c(c5)C(=O)N(C)C6=O)C(F)(F)F)cc4C3=O)cc2C(F)(F)F)c(C)c1
InChIInChI=1S/C63H47F3N4O6.C61H43F3N4O6.C59H39F3N4O6.C58H39F3N4O10S.C35H24F6N2O4.C32H21F3N2O4/c1-32-16-20-43(33(2)24-32)46-23-19-42(31-53(46)63(64,65)66)70-60(75)48-22-18-39(30-50(48)61(70)76)57(72)68-55-36(5)27-41(28-37(55)6)62(51-14-10-8-12-44(51)45-13-9-11-15-52(45)62)40-25-34(3)54(35(4)26-40)67-56(71)38-17-21-47-49(29-38)59(74)69(7)58(47)73;1-32-14-20-41(33(2)26-32)44-23-19-40(31-51(44)61(62,63)64)68-58(73)46-22-16-37(30-48(46)59(68)74)55(70)66-53-25-18-39(28-35(53)4)60(49-12-8-6-10-42(49)43-11-7-9-13-50(43)60)38-17-24-52(34(3)27-38)65-54(69)36-15-21-45-47(29-36)57(72)67(5)56(45)71;1-32-12-24-41(33(2)28-32)44-27-23-40(31-51(44)59(60,61)62)66-56(71)46-26-14-35(30-48(46)57(66)72)53(68)64-39-21-17-37(18-22-39)58(49-10-6-4-8-42(49)43-9-5-7-11-50(43)58)36-15-19-38(20-16-36)63-52(67)34-13-25-45-47(29-34)55(70)65(3)54(45)69;1-32-4-24-45(33(2)28-32)46-27-11-38(31-51(46)58(59,60)61)65-56(70)48-26-6-35(30-50(48)57(65)71)53(67)63-37-9-14-40(15-10-37)75-42-18-22-44(23-19-42)76(72,73)43-20-16-41(17-21-43)74-39-12-7-36(8-13-39)62-52(66)34-5-25-47-49(29-34)55(69)64(3)54(47)68;1-17-5-9-22(18(2)13-17)23-12-8-21(16-28(23)34(36,37)38)43-31(46)25-11-7-20(15-27(25)32(43)47)33(3,35(39,40)41)19-6-10-24-26(14-19)30(45)42(4)29(24)44;1-16-4-8-21(17(2)12-16)22-11-7-20(15-27(22)32(33,34)35)37-30(40)24-10-6-19(14-26(24)31(37)41)18-5-9-23-25(13-18)29(39)36(3)28(23)38/h8-31H,1-7H3,(H,67,71)(H,68,72);6-31H,1-5H3,(H,65,69)(H,66,70);4-31H,1-3H3,(H,63,67)(H,64,68);4-31H,1-3H3,(H,62,66)(H,63,67);5-16H,1-4H3;4-15H,1-3H3
InChIKeyAVAKYHWTANDEJA-UHFFFAOYSA-N
XLogP64.00
TPSA733.96 Ų
H-Bond Donors8
H-Bond Acceptors36
Rotatable Bonds43
Heavy Atoms386
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005201.22
LogP ≤ 564.00
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1036

Analyze N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3,5-dimethylphenyl]fluoren-9-yl]-2,6-dimethylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3-methylphenyl]fluoren-9-yl]-2-methylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[4-[4-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenoxy]phenyl]sulfonylphenoxy]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenyl]fluoren-9-yl]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;5-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-2-methylisoindole-1,3-dione;5-[2-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3,5-dimethylphenyl]fluoren-9-yl]-2,6-dimethylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3-methylphenyl]fluoren-9-yl]-2-methylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[4-[4-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenoxy]phenyl]sulfonylphenoxy]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenyl]fluoren-9-yl]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;5-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-2-methylisoindole-1,3-dione;5-[2-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione?
The IUPAC name of N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3,5-dimethylphenyl]fluoren-9-yl]-2,6-dimethylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3-methylphenyl]fluoren-9-yl]-2-methylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[4-[4-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenoxy]phenyl]sulfonylphenoxy]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenyl]fluoren-9-yl]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;5-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-2-methylisoindole-1,3-dione;5-[2-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione (CID 157239428) is N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3,5-dimethylphenyl]fluoren-9-yl]-2,6-dimethylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3-methylphenyl]fluoren-9-yl]-2-methylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[4-[4-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenoxy]phenyl]sulfonylphenoxy]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenyl]fluoren-9-yl]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;5-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-2-methylisoindole-1,3-dione;5-[2-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione.
What is the SMILES notation for N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3,5-dimethylphenyl]fluoren-9-yl]-2,6-dimethylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3-methylphenyl]fluoren-9-yl]-2-methylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[4-[4-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenoxy]phenyl]sulfonylphenoxy]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenyl]fluoren-9-yl]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;5-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-2-methylisoindole-1,3-dione;5-[2-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione?
The canonical SMILES for N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3,5-dimethylphenyl]fluoren-9-yl]-2,6-dimethylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3-methylphenyl]fluoren-9-yl]-2-methylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[4-[4-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenoxy]phenyl]sulfonylphenoxy]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenyl]fluoren-9-yl]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;5-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-2-methylisoindole-1,3-dione;5-[2-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione is Cc1ccc(-c2ccc(N3C(=O)c4ccc(-c5ccc6c(c5)C(=O)N(C)C6=O)cc4C3=O)cc2C(F)(F)F)c(C)c1.Cc1ccc(-c2ccc(N3C(=O)c4ccc(C(=O)Nc5c(C)cc(C6(c7cc(C)c(NC(=O)c8ccc9c(c8)C(=O)N(C)C9=O)c(C)c7)c7ccccc7-c7ccccc76)cc5C)cc4C3=O)cc2C(F)(F)F)c(C)c1.Cc1ccc(-c2ccc(N3C(=O)c4ccc(C(=O)Nc5ccc(C6(c7ccc(NC(=O)c8ccc9c(c8)C(=O)N(C)C9=O)c(C)c7)c7ccccc7-c7ccccc76)cc5C)cc4C3=O)cc2C(F)(F)F)c(C)c1.Cc1ccc(-c2ccc(N3C(=O)c4ccc(C(=O)Nc5ccc(C6(c7ccc(NC(=O)c8ccc9c(c8)C(=O)N(C)C9=O)cc7)c7ccccc7-c7ccccc76)cc5)cc4C3=O)cc2C(F)(F)F)c(C)c1.Cc1ccc(-c2ccc(N3C(=O)c4ccc(C(=O)Nc5ccc(Oc6ccc(S(=O)(=O)c7ccc(Oc8ccc(NC(=O)c9ccc%10c(c9)C(=O)N(C)C%10=O)cc8)cc7)cc6)cc5)cc4C3=O)cc2C(F)(F)F)c(C)c1.Cc1ccc(-c2ccc(N3C(=O)c4ccc(C(C)(c5ccc6c(c5)C(=O)N(C)C6=O)C(F)(F)F)cc4C3=O)cc2C(F)(F)F)c(C)c1.
What is the InChIKey of N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3,5-dimethylphenyl]fluoren-9-yl]-2,6-dimethylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3-methylphenyl]fluoren-9-yl]-2-methylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[4-[4-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenoxy]phenyl]sulfonylphenoxy]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenyl]fluoren-9-yl]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;5-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-2-methylisoindole-1,3-dione;5-[2-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione?
The InChIKey is AVAKYHWTANDEJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H47F3N4O6.C61H43F3N4O6.C59H39F3N4O6.C58H39F3N4O10S.C35H24F6N2O4.C32H21F3N2O4/c1-32-16-20-43(33(2)24-32)46-23-19-42(31-53(46)63(64,65)66)70-60(75)48-22-18-39(30-50(48)61(70)76)57(72)68-55-36(5)27-41(28-37(55)6)62(51-14-10-8-12-44(51)45-13-9-11-15-52(45)62)40-25-34(3)54(35(4)26-40)67-56(71)38-17-21-47-49(29-38)59(74)69(7)58(47)73;1-32-14-20-41(33(2)26-32)44-23-19-40(31-51(44)61(62,63)64)68-58(73)46-22-16-37(30-48(46)59(68)74)55(70)66-53-25-18-39(28-35(53)4)60(49-12-8-6-10-42(49)43-11-7-9-13-50(43)60)38-17-24-52(34(3)27-38)65-54(69)36-15-21-45-47(29-36)57(72)67(5)56(45)71;1-32-12-24-41(33(2)28-32)44-27-23-40(31-51(44)59(60,61)62)66-56(71)46-26-14-35(30-48(46)57(66)72)53(68)64-39-21-17-37(18-22-39)58(49-10-6-4-8-42(49)43-9-5-7-11-50(43)58)36-15-19-38(20-16-36)63-52(67)34-13-25-45-47(29-34)55(70)65(3)54(45)69;1-32-4-24-45(33(2)28-32)46-27-11-38(31-51(46)58(59,60)61)65-56(70)48-26-6-35(30-50(48)57(65)71)53(67)63-37-9-14-40(15-10-37)75-42-18-22-44(23-19-42)76(72,73)43-20-16-41(17-21-43)74-39-12-7-36(8-13-39)62-52(66)34-5-25-47-49(29-34)55(69)64(3)54(47)68;1-17-5-9-22(18(2)13-17)23-12-8-21(16-28(23)34(36,37)38)43-31(46)25-11-7-20(15-27(25)32(43)47)33(3,35(39,40)41)19-6-10-24-26(14-19)30(45)42(4)29(24)44;1-16-4-8-21(17(2)12-16)22-11-7-20(15-27(22)32(33,34)35)37-30(40)24-10-6-19(14-26(24)31(37)41)18-5-9-23-25(13-18)29(39)36(3)28(23)38/h8-31H,1-7H3,(H,67,71)(H,68,72);6-31H,1-5H3,(H,65,69)(H,66,70);4-31H,1-3H3,(H,63,67)(H,64,68);4-31H,1-3H3,(H,62,66)(H,63,67);5-16H,1-4H3;4-15H,1-3H3.
What are the key properties of N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3,5-dimethylphenyl]fluoren-9-yl]-2,6-dimethylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3-methylphenyl]fluoren-9-yl]-2-methylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[4-[4-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenoxy]phenyl]sulfonylphenoxy]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenyl]fluoren-9-yl]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;5-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-2-methylisoindole-1,3-dione;5-[2-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione?
N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3,5-dimethylphenyl]fluoren-9-yl]-2,6-dimethylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3-methylphenyl]fluoren-9-yl]-2-methylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[4-[4-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenoxy]phenyl]sulfonylphenoxy]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenyl]fluoren-9-yl]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;5-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-2-methylisoindole-1,3-dione;5-[2-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione has a molecular weight of 5201.22 g/mol, XLogP of 64.00, 43 rotatable bonds, 8 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3,5-dimethylphenyl]fluoren-9-yl]-2,6-dimethylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]-3-methylphenyl]fluoren-9-yl]-2-methylphenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[4-[4-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenoxy]phenyl]sulfonylphenoxy]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;N-[4-[9-[4-[[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindole-5-carbonyl]amino]phenyl]fluoren-9-yl]phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide;5-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-2-methylisoindole-1,3-dione;5-[2-[2-[4-(2,4-dimethylphenyl)-3-(trifluoromethyl)phenyl]-1,3-dioxoisoindol-5-yl]-1,1,1-trifluoropropan-2-yl]-2-methylisoindole-1,3-dione is sourced from PubChem (CID 157239428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).