5-[2-[4-[2-(4-but-3-enylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-1,3-difluorobenzene;5-butoxy-2-[2-[4-[2-[4-[difluoro-(3,4,5-trifluorophenoxy)methyl]-3,5-difluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]pyridine;5-[2-[4-[2-(4-butoxyphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluorobenzene;5-[2-[4-[2-(4-butylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluorobenzene;1-chloro-5-[[2,6-difluoro-4-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]phenyl]-difluoromethoxy]-2,3-difluorobenzene;2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-[4-[(E)-pent-3-enyl]phenyl]ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-[(E)-pent-3-enyl]pyrimidine;2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-pentylpyridine

C304H182ClF81N4O14 — CID 159297519

IUPAC5-[2-[4-[2-(4-but-3-enylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-1,3-difluorobenzene;5-butoxy-2-[2-[4-[2-[4-[difluoro-(3,4,5-trifluorophenoxy)methyl]-3,5-difluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]pyridine;5-[2-[4-[2-(4-butoxyphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluorobenzene;5-[2-[4-[2-(4-butylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluorobenzene;1-chloro-5-[[2,6-difluoro-4-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]phenyl]-difluoromethoxy]-2,3-difluorobenzene;2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-[4-[(E)-pent-3-enyl]phenyl]ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-[(E)-pent-3-enyl]pyrimidine;2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-pentylpyridine
SMILESC/C=C/CCc1ccc(C#Cc2ccc(C#Cc3cc(F)c(C(F)(F)Oc4cc(F)c(OC(F)(F)F)c(F)c4)c(F)c3)c(F)c2)cc1.C/C=C/CCc1cnc(C#Cc2ccc(C#Cc3ccc(C(F)(F)Oc4cc(F)c(OC(F)(F)F)c(F)c4)c(F)c3)c(F)c2)nc1.C=CCCc1ccc(C#Cc2ccc(C#Cc3cc(F)c(C(F)(F)Oc4cc(F)c(F)c(F)c4)c(F)c3)c(F)c2)cc1.CCCCCc1ccc(C#Cc2ccc(C#Cc3cc(F)c(C(F)(F)Oc4cc(F)c(C(F)(F)F)c(F)c4)c(F)c3)c(F)c2)cc1.CCCCCc1ccc(C#Cc2ccc(C#Cc3cc(F)c(C(F)(F)Oc4cc(F)c(F)c(Cl)c4)c(F)c3)c(F)c2)cc1.CCCCCc1ccc(C#Cc2ccc(C#Cc3ccc(C(F)(F)Oc4cc(F)c(C(F)(F)F)c(F)c4)c(F)c3)c(F)c2)nc1.CCCCOc1ccc(C#Cc2ccc(C#Cc3cc(F)c(C(F)(F)Oc4cc(F)c(C(F)(F)F)c(F)c4)c(F)c3)c(F)c2)cc1.CCCCOc1ccc(C#Cc2ccc(C#Cc3cc(F)c(C(F)(F)Oc4cc(F)c(F)c(F)c4)c(F)c3)c(F)c2)nc1.CCCCc1ccc(C#Cc2ccc(C#Cc3cc(F)c(C(F)(F)Oc4cc(F)c(OC(F)(F)F)c(F)c4)c(F)c3)c(F)c2)cc1
InChIInChI=1S/C35H20F10O2.C35H22F10O.C34H22ClF7O.2C34H20F10O2.C34H22F9NO.C33H19F9N2O2.C33H18F8O.C32H19F8NO2/c1-2-3-4-5-21-6-8-22(9-7-21)10-11-23-12-14-25(27(36)16-23)15-13-24-17-28(37)32(29(38)18-24)34(41,42)46-26-19-30(39)33(31(40)20-26)47-35(43,44)45;1-2-3-4-5-21-6-8-22(9-7-21)10-11-23-12-14-25(27(36)16-23)15-13-24-17-28(37)33(29(38)18-24)35(44,45)46-26-19-30(39)32(31(40)20-26)34(41,42)43;1-2-3-4-5-21-6-8-22(9-7-21)10-11-23-12-14-25(28(36)16-23)15-13-24-17-29(37)32(30(38)18-24)34(41,42)43-26-19-27(35)33(40)31(39)20-26;1-2-3-14-45-24-12-8-20(9-13-24)4-5-21-6-10-23(26(35)15-21)11-7-22-16-27(36)32(28(37)17-22)34(43,44)46-25-18-29(38)31(30(39)19-25)33(40,41)42;1-2-3-4-20-5-7-21(8-6-20)9-10-22-11-13-24(26(35)15-22)14-12-23-16-27(36)31(28(37)17-23)33(40,41)45-25-18-29(38)32(30(39)19-25)46-34(42,43)44;1-2-3-4-5-23-9-14-25(44-20-23)13-8-21-6-11-24(28(35)16-21)12-7-22-10-15-27(29(36)17-22)34(42,43)45-26-18-30(37)32(31(38)19-26)33(39,40)41;1-2-3-4-5-22-18-43-30(44-19-22)13-9-21-7-11-23(26(34)14-21)10-6-20-8-12-25(27(35)15-20)32(38,39)45-24-16-28(36)31(29(37)17-24)46-33(40,41)42;1-2-3-4-20-5-7-21(8-6-20)9-10-22-11-13-24(26(34)15-22)14-12-23-16-27(35)31(28(36)17-23)33(40,41)42-25-18-29(37)32(39)30(38)19-25;1-2-3-12-42-23-11-10-22(41-18-23)9-6-19-4-7-21(25(33)13-19)8-5-20-14-26(34)30(27(35)15-20)32(39,40)43-24-16-28(36)31(38)29(37)17-24/h2-3,6-9,12,14,16-20H,4-5H2,1H3;6-9,12,14,16-20H,2-5H2,1H3;6-9,12,14,16-20H,2-5H2,1H3;6,8-10,12-13,15-19H,2-3,14H2,1H3;5-8,11,13,15-19H,2-4H2,1H3;6,9-11,14-20H,2-5H2,1H3;2-3,7-8,11-12,14-19H,4-5H2,1H3;2,5-8,11,13,15-19H,1,3-4H2;4,7,10-11,13-18H,2-3,12H2,1H3/b3-2+;;;;;;3-2+;;
InChIKeyLAXLEYQCJKGDLO-DIPJTIMLSA-N
MW5689.11 g/mol
LogP82.81
Rot. Bonds62

About 5-[2-[4-[2-(4-but-3-enylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-1,3-difluorobenzene;5-butoxy-2-[2-[4-[2-[4-[difluoro-(3,4,5-trifluorophenoxy)methyl]-3,5-difluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]pyridine;5-[2-[4-[2-(4-butoxyphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluorobenzene;5-[2-[4-[2-(4-butylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluorobenzene;1-chloro-5-[[2,6-difluoro-4-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]phenyl]-difluoromethoxy]-2,3-difluorobenzene;2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-[4-[(E)-pent-3-enyl]phenyl]ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-[(E)-pent-3-enyl]pyrimidine;2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-pentylpyridine

5-[2-[4-[2-(4-but-3-enylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-1,3-difluorobenzene;5-butoxy-2-[2-[4-[2-[4-[difluoro-(3,4,5-trifluorophenoxy)methyl]-3,5-difluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]pyridine;5-[2-[4-[2-(4-butoxyphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluorobenzene;5-[2-[4-[2-(4-butylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluorobenzene;1-chloro-5-[[2,6-difluoro-4-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]phenyl]-difluoromethoxy]-2,3-difluorobenzene;2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-[4-[(E)-pent-3-enyl]phenyl]ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-[(E)-pent-3-enyl]pyrimidine;2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-pentylpyridine (PubChem CID 159297519) has the molecular formula C304H182ClF81N4O14 and a molecular weight of 5689.11 g/mol. Its IUPAC name is 5-[2-[4-[2-(4-but-3-enylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-1,3-difluorobenzene;5-butoxy-2-[2-[4-[2-[4-[difluoro-(3,4,5-trifluorophenoxy)methyl]-3,5-difluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]pyridine;5-[2-[4-[2-(4-butoxyphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluorobenzene;5-[2-[4-[2-(4-butylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluorobenzene;1-chloro-5-[[2,6-difluoro-4-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]phenyl]-difluoromethoxy]-2,3-difluorobenzene;2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-[4-[(E)-pent-3-enyl]phenyl]ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-[(E)-pent-3-enyl]pyrimidine;2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-pentylpyridine.

Molecular Properties

Compound Name5-[2-[4-[2-(4-but-3-enylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-1,3-difluorobenzene;5-butoxy-2-[2-[4-[2-[4-[difluoro-(3,4,5-trifluorophenoxy)methyl]-3,5-difluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]pyridine;5-[2-[4-[2-(4-butoxyphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluorobenzene;5-[2-[4-[2-(4-butylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluorobenzene;1-chloro-5-[[2,6-difluoro-4-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]phenyl]-difluoromethoxy]-2,3-difluorobenzene;2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-[4-[(E)-pent-3-enyl]phenyl]ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-[(E)-pent-3-enyl]pyrimidine;2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-pentylpyridine
PubChem CID159297519
Molecular FormulaC304H182ClF81N4O14
Molecular Weight5689.11 g/mol
Exact Mass5685.20
IUPAC Name5-[2-[4-[2-(4-but-3-enylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-1,3-difluorobenzene;5-butoxy-2-[2-[4-[2-[4-[difluoro-(3,4,5-trifluorophenoxy)methyl]-3,5-difluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]pyridine;5-[2-[4-[2-(4-butoxyphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluorobenzene;5-[2-[4-[2-(4-butylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluorobenzene;1-chloro-5-[[2,6-difluoro-4-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]phenyl]-difluoromethoxy]-2,3-difluorobenzene;2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-[4-[(E)-pent-3-enyl]phenyl]ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-[(E)-pent-3-enyl]pyrimidine;2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-pentylpyridine
SMILESC/C=C/CCc1ccc(C#Cc2ccc(C#Cc3cc(F)c(C(F)(F)Oc4cc(F)c(OC(F)(F)F)c(F)c4)c(F)c3)c(F)c2)cc1.C/C=C/CCc1cnc(C#Cc2ccc(C#Cc3ccc(C(F)(F)Oc4cc(F)c(OC(F)(F)F)c(F)c4)c(F)c3)c(F)c2)nc1.C=CCCc1ccc(C#Cc2ccc(C#Cc3cc(F)c(C(F)(F)Oc4cc(F)c(F)c(F)c4)c(F)c3)c(F)c2)cc1.CCCCCc1ccc(C#Cc2ccc(C#Cc3cc(F)c(C(F)(F)Oc4cc(F)c(C(F)(F)F)c(F)c4)c(F)c3)c(F)c2)cc1.CCCCCc1ccc(C#Cc2ccc(C#Cc3cc(F)c(C(F)(F)Oc4cc(F)c(F)c(Cl)c4)c(F)c3)c(F)c2)cc1.CCCCCc1ccc(C#Cc2ccc(C#Cc3ccc(C(F)(F)Oc4cc(F)c(C(F)(F)F)c(F)c4)c(F)c3)c(F)c2)nc1.CCCCOc1ccc(C#Cc2ccc(C#Cc3cc(F)c(C(F)(F)Oc4cc(F)c(C(F)(F)F)c(F)c4)c(F)c3)c(F)c2)cc1.CCCCOc1ccc(C#Cc2ccc(C#Cc3cc(F)c(C(F)(F)Oc4cc(F)c(F)c(F)c4)c(F)c3)c(F)c2)nc1.CCCCc1ccc(C#Cc2ccc(C#Cc3cc(F)c(C(F)(F)Oc4cc(F)c(OC(F)(F)F)c(F)c4)c(F)c3)c(F)c2)cc1
InChIInChI=1S/C35H20F10O2.C35H22F10O.C34H22ClF7O.2C34H20F10O2.C34H22F9NO.C33H19F9N2O2.C33H18F8O.C32H19F8NO2/c1-2-3-4-5-21-6-8-22(9-7-21)10-11-23-12-14-25(27(36)16-23)15-13-24-17-28(37)32(29(38)18-24)34(41,42)46-26-19-30(39)33(31(40)20-26)47-35(43,44)45;1-2-3-4-5-21-6-8-22(9-7-21)10-11-23-12-14-25(27(36)16-23)15-13-24-17-28(37)33(29(38)18-24)35(44,45)46-26-19-30(39)32(31(40)20-26)34(41,42)43;1-2-3-4-5-21-6-8-22(9-7-21)10-11-23-12-14-25(28(36)16-23)15-13-24-17-29(37)32(30(38)18-24)34(41,42)43-26-19-27(35)33(40)31(39)20-26;1-2-3-14-45-24-12-8-20(9-13-24)4-5-21-6-10-23(26(35)15-21)11-7-22-16-27(36)32(28(37)17-22)34(43,44)46-25-18-29(38)31(30(39)19-25)33(40,41)42;1-2-3-4-20-5-7-21(8-6-20)9-10-22-11-13-24(26(35)15-22)14-12-23-16-27(36)31(28(37)17-23)33(40,41)45-25-18-29(38)32(30(39)19-25)46-34(42,43)44;1-2-3-4-5-23-9-14-25(44-20-23)13-8-21-6-11-24(28(35)16-21)12-7-22-10-15-27(29(36)17-22)34(42,43)45-26-18-30(37)32(31(38)19-26)33(39,40)41;1-2-3-4-5-22-18-43-30(44-19-22)13-9-21-7-11-23(26(34)14-21)10-6-20-8-12-25(27(35)15-20)32(38,39)45-24-16-28(36)31(29(37)17-24)46-33(40,41)42;1-2-3-4-20-5-7-21(8-6-20)9-10-22-11-13-24(26(34)15-22)14-12-23-16-27(35)31(28(36)17-23)33(40,41)42-25-18-29(37)32(39)30(38)19-25;1-2-3-12-42-23-11-10-22(41-18-23)9-6-19-4-7-21(25(33)13-19)8-5-20-14-26(34)30(27(35)15-20)32(39,40)43-24-16-28(36)31(38)29(37)17-24/h2-3,6-9,12,14,16-20H,4-5H2,1H3;6-9,12,14,16-20H,2-5H2,1H3;6-9,12,14,16-20H,2-5H2,1H3;6,8-10,12-13,15-19H,2-3,14H2,1H3;5-8,11,13,15-19H,2-4H2,1H3;6,9-11,14-20H,2-5H2,1H3;2-3,7-8,11-12,14-19H,4-5H2,1H3;2,5-8,11,13,15-19H,1,3-4H2;4,7,10-11,13-18H,2-3,12H2,1H3/b3-2+;;;;;;3-2+;;
InChIKeyLAXLEYQCJKGDLO-DIPJTIMLSA-N
XLogP82.81
TPSA180.78 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds62
Heavy Atoms404
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005689.11
LogP ≤ 582.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 5-[2-[4-[2-(4-but-3-enylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-1,3-difluorobenzene;5-butoxy-2-[2-[4-[2-[4-[difluoro-(3,4,5-trifluorophenoxy)methyl]-3,5-difluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]pyridine;5-[2-[4-[2-(4-butoxyphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluorobenzene;5-[2-[4-[2-(4-butylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluorobenzene;1-chloro-5-[[2,6-difluoro-4-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]phenyl]-difluoromethoxy]-2,3-difluorobenzene;2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-[4-[(E)-pent-3-enyl]phenyl]ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-[(E)-pent-3-enyl]pyrimidine;2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-pentylpyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-[2-[4-[2-(4-but-3-enylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-1,3-difluorobenzene;5-butoxy-2-[2-[4-[2-[4-[difluoro-(3,4,5-trifluorophenoxy)methyl]-3,5-difluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]pyridine;5-[2-[4-[2-(4-butoxyphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluorobenzene;5-[2-[4-[2-(4-butylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluorobenzene;1-chloro-5-[[2,6-difluoro-4-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]phenyl]-difluoromethoxy]-2,3-difluorobenzene;2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-[4-[(E)-pent-3-enyl]phenyl]ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-[(E)-pent-3-enyl]pyrimidine;2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-pentylpyridine?
The IUPAC name of 5-[2-[4-[2-(4-but-3-enylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-1,3-difluorobenzene;5-butoxy-2-[2-[4-[2-[4-[difluoro-(3,4,5-trifluorophenoxy)methyl]-3,5-difluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]pyridine;5-[2-[4-[2-(4-butoxyphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluorobenzene;5-[2-[4-[2-(4-butylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluorobenzene;1-chloro-5-[[2,6-difluoro-4-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]phenyl]-difluoromethoxy]-2,3-difluorobenzene;2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-[4-[(E)-pent-3-enyl]phenyl]ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-[(E)-pent-3-enyl]pyrimidine;2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-pentylpyridine (CID 159297519) is 5-[2-[4-[2-(4-but-3-enylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-1,3-difluorobenzene;5-butoxy-2-[2-[4-[2-[4-[difluoro-(3,4,5-trifluorophenoxy)methyl]-3,5-difluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]pyridine;5-[2-[4-[2-(4-butoxyphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluorobenzene;5-[2-[4-[2-(4-butylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluorobenzene;1-chloro-5-[[2,6-difluoro-4-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]phenyl]-difluoromethoxy]-2,3-difluorobenzene;2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-[4-[(E)-pent-3-enyl]phenyl]ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-[(E)-pent-3-enyl]pyrimidine;2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-pentylpyridine.
What is the SMILES notation for 5-[2-[4-[2-(4-but-3-enylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-1,3-difluorobenzene;5-butoxy-2-[2-[4-[2-[4-[difluoro-(3,4,5-trifluorophenoxy)methyl]-3,5-difluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]pyridine;5-[2-[4-[2-(4-butoxyphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluorobenzene;5-[2-[4-[2-(4-butylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluorobenzene;1-chloro-5-[[2,6-difluoro-4-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]phenyl]-difluoromethoxy]-2,3-difluorobenzene;2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-[4-[(E)-pent-3-enyl]phenyl]ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-[(E)-pent-3-enyl]pyrimidine;2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-pentylpyridine?
The canonical SMILES for 5-[2-[4-[2-(4-but-3-enylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-1,3-difluorobenzene;5-butoxy-2-[2-[4-[2-[4-[difluoro-(3,4,5-trifluorophenoxy)methyl]-3,5-difluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]pyridine;5-[2-[4-[2-(4-butoxyphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluorobenzene;5-[2-[4-[2-(4-butylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluorobenzene;1-chloro-5-[[2,6-difluoro-4-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]phenyl]-difluoromethoxy]-2,3-difluorobenzene;2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-[4-[(E)-pent-3-enyl]phenyl]ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-[(E)-pent-3-enyl]pyrimidine;2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-pentylpyridine is C/C=C/CCc1ccc(C#Cc2ccc(C#Cc3cc(F)c(C(F)(F)Oc4cc(F)c(OC(F)(F)F)c(F)c4)c(F)c3)c(F)c2)cc1.C/C=C/CCc1cnc(C#Cc2ccc(C#Cc3ccc(C(F)(F)Oc4cc(F)c(OC(F)(F)F)c(F)c4)c(F)c3)c(F)c2)nc1.C=CCCc1ccc(C#Cc2ccc(C#Cc3cc(F)c(C(F)(F)Oc4cc(F)c(F)c(F)c4)c(F)c3)c(F)c2)cc1.CCCCCc1ccc(C#Cc2ccc(C#Cc3cc(F)c(C(F)(F)Oc4cc(F)c(C(F)(F)F)c(F)c4)c(F)c3)c(F)c2)cc1.CCCCCc1ccc(C#Cc2ccc(C#Cc3cc(F)c(C(F)(F)Oc4cc(F)c(F)c(Cl)c4)c(F)c3)c(F)c2)cc1.CCCCCc1ccc(C#Cc2ccc(C#Cc3ccc(C(F)(F)Oc4cc(F)c(C(F)(F)F)c(F)c4)c(F)c3)c(F)c2)nc1.CCCCOc1ccc(C#Cc2ccc(C#Cc3cc(F)c(C(F)(F)Oc4cc(F)c(C(F)(F)F)c(F)c4)c(F)c3)c(F)c2)cc1.CCCCOc1ccc(C#Cc2ccc(C#Cc3cc(F)c(C(F)(F)Oc4cc(F)c(F)c(F)c4)c(F)c3)c(F)c2)nc1.CCCCc1ccc(C#Cc2ccc(C#Cc3cc(F)c(C(F)(F)Oc4cc(F)c(OC(F)(F)F)c(F)c4)c(F)c3)c(F)c2)cc1.
What is the InChIKey of 5-[2-[4-[2-(4-but-3-enylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-1,3-difluorobenzene;5-butoxy-2-[2-[4-[2-[4-[difluoro-(3,4,5-trifluorophenoxy)methyl]-3,5-difluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]pyridine;5-[2-[4-[2-(4-butoxyphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluorobenzene;5-[2-[4-[2-(4-butylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluorobenzene;1-chloro-5-[[2,6-difluoro-4-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]phenyl]-difluoromethoxy]-2,3-difluorobenzene;2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-[4-[(E)-pent-3-enyl]phenyl]ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-[(E)-pent-3-enyl]pyrimidine;2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-pentylpyridine?
The InChIKey is LAXLEYQCJKGDLO-DIPJTIMLSA-N. The full InChI is InChI=1S/C35H20F10O2.C35H22F10O.C34H22ClF7O.2C34H20F10O2.C34H22F9NO.C33H19F9N2O2.C33H18F8O.C32H19F8NO2/c1-2-3-4-5-21-6-8-22(9-7-21)10-11-23-12-14-25(27(36)16-23)15-13-24-17-28(37)32(29(38)18-24)34(41,42)46-26-19-30(39)33(31(40)20-26)47-35(43,44)45;1-2-3-4-5-21-6-8-22(9-7-21)10-11-23-12-14-25(27(36)16-23)15-13-24-17-28(37)33(29(38)18-24)35(44,45)46-26-19-30(39)32(31(40)20-26)34(41,42)43;1-2-3-4-5-21-6-8-22(9-7-21)10-11-23-12-14-25(28(36)16-23)15-13-24-17-29(37)32(30(38)18-24)34(41,42)43-26-19-27(35)33(40)31(39)20-26;1-2-3-14-45-24-12-8-20(9-13-24)4-5-21-6-10-23(26(35)15-21)11-7-22-16-27(36)32(28(37)17-22)34(43,44)46-25-18-29(38)31(30(39)19-25)33(40,41)42;1-2-3-4-20-5-7-21(8-6-20)9-10-22-11-13-24(26(35)15-22)14-12-23-16-27(36)31(28(37)17-23)33(40,41)45-25-18-29(38)32(30(39)19-25)46-34(42,43)44;1-2-3-4-5-23-9-14-25(44-20-23)13-8-21-6-11-24(28(35)16-21)12-7-22-10-15-27(29(36)17-22)34(42,43)45-26-18-30(37)32(31(38)19-26)33(39,40)41;1-2-3-4-5-22-18-43-30(44-19-22)13-9-21-7-11-23(26(34)14-21)10-6-20-8-12-25(27(35)15-20)32(38,39)45-24-16-28(36)31(29(37)17-24)46-33(40,41)42;1-2-3-4-20-5-7-21(8-6-20)9-10-22-11-13-24(26(34)15-22)14-12-23-16-27(35)31(28(36)17-23)33(40,41)42-25-18-29(37)32(39)30(38)19-25;1-2-3-12-42-23-11-10-22(41-18-23)9-6-19-4-7-21(25(33)13-19)8-5-20-14-26(34)30(27(35)15-20)32(39,40)43-24-16-28(36)31(38)29(37)17-24/h2-3,6-9,12,14,16-20H,4-5H2,1H3;6-9,12,14,16-20H,2-5H2,1H3;6-9,12,14,16-20H,2-5H2,1H3;6,8-10,12-13,15-19H,2-3,14H2,1H3;5-8,11,13,15-19H,2-4H2,1H3;6,9-11,14-20H,2-5H2,1H3;2-3,7-8,11-12,14-19H,4-5H2,1H3;2,5-8,11,13,15-19H,1,3-4H2;4,7,10-11,13-18H,2-3,12H2,1H3/b3-2+;;;;;;3-2+;;.
What are the key properties of 5-[2-[4-[2-(4-but-3-enylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-1,3-difluorobenzene;5-butoxy-2-[2-[4-[2-[4-[difluoro-(3,4,5-trifluorophenoxy)methyl]-3,5-difluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]pyridine;5-[2-[4-[2-(4-butoxyphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluorobenzene;5-[2-[4-[2-(4-butylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluorobenzene;1-chloro-5-[[2,6-difluoro-4-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]phenyl]-difluoromethoxy]-2,3-difluorobenzene;2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-[4-[(E)-pent-3-enyl]phenyl]ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-[(E)-pent-3-enyl]pyrimidine;2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-pentylpyridine?
5-[2-[4-[2-(4-but-3-enylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-1,3-difluorobenzene;5-butoxy-2-[2-[4-[2-[4-[difluoro-(3,4,5-trifluorophenoxy)methyl]-3,5-difluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]pyridine;5-[2-[4-[2-(4-butoxyphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluorobenzene;5-[2-[4-[2-(4-butylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluorobenzene;1-chloro-5-[[2,6-difluoro-4-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]phenyl]-difluoromethoxy]-2,3-difluorobenzene;2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-[4-[(E)-pent-3-enyl]phenyl]ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-[(E)-pent-3-enyl]pyrimidine;2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-pentylpyridine has a molecular weight of 5689.11 g/mol, XLogP of 82.81, 62 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-[4-[2-(4-but-3-enylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-1,3-difluorobenzene;5-butoxy-2-[2-[4-[2-[4-[difluoro-(3,4,5-trifluorophenoxy)methyl]-3,5-difluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]pyridine;5-[2-[4-[2-(4-butoxyphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluorobenzene;5-[2-[4-[2-(4-butylphenyl)ethynyl]-2-fluorophenyl]ethynyl]-2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluorobenzene;1-chloro-5-[[2,6-difluoro-4-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]phenyl]-difluoromethoxy]-2,3-difluorobenzene;2-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-[4-[(E)-pent-3-enyl]phenyl]ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethoxy)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-[(E)-pent-3-enyl]pyrimidine;2-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-[2-fluoro-4-[2-(4-pentylphenyl)ethynyl]phenyl]ethynyl]benzene;2-[2-[4-[2-[4-[[3,5-difluoro-4-(trifluoromethyl)phenoxy]-difluoromethyl]-3-fluorophenyl]ethynyl]-3-fluorophenyl]ethynyl]-5-pentylpyridine is sourced from PubChem (CID 159297519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).