4-[4-[4-[8-[3,5-bis(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-(3,5-dimethylphenyl)-[1]benzofuro[3,2-b]pyridine;8-(2,3,4,5,6-pentafluorophenyl)-4-[4-[8-(2,3,4,5,6-pentafluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;4-[4-[4-[8-(2,3,5,6-tetrafluoro-4-methylphenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridine;8-(2,4,6-trifluorophenyl)-4-[4-[8-(2,4,6-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-(3,4,5-trifluorophenyl)-4-[4-[8-(3,4,5-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine

C218H101F39N10O10 — CID 158613535

IUPAC4-[4-[4-[8-[3,5-bis(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-(3,5-dimethylphenyl)-[1]benzofuro[3,2-b]pyridine;8-(2,3,4,5,6-pentafluorophenyl)-4-[4-[8-(2,3,4,5,6-pentafluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;4-[4-[4-[8-(2,3,5,6-tetrafluoro-4-methylphenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridine;8-(2,4,6-trifluorophenyl)-4-[4-[8-(2,4,6-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-(3,4,5-trifluorophenyl)-4-[4-[8-(3,4,5-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine
SMILESCc1c(F)c(F)c(-c2ccc3oc4c(-c5ccc(-c6ccc(-c7ccnc8c7oc7ccc(-c9c(F)c(F)c(C(F)(F)F)c(F)c9F)cc78)cc6)cc5)ccnc4c3c2)c(F)c1F.Cc1cc(C)cc(-c2ccc3oc4c(-c5ccc(-c6ccc(-c7ccnc8c7oc7ccc(-c9cc(C(F)(F)F)cc(C(F)(F)F)c9)cc78)cc6)cc5)ccnc4c3c2)c1.Fc1c(F)c(F)c(-c2ccc3oc4c(-c5ccc(-c6ccnc7c6oc6ccc(-c8c(F)c(F)c(F)c(F)c8F)cc67)cc5)ccnc4c3c2)c(F)c1F.Fc1cc(-c2ccc3oc4c(-c5ccc(-c6ccnc7c6oc6ccc(-c8cc(F)c(F)c(F)c8)cc67)cc5)ccnc4c3c2)cc(F)c1F.Fc1cc(F)c(-c2ccc3oc4c(-c5ccc(-c6ccnc7c6oc6ccc(-c8c(F)cc(F)cc8F)cc67)cc5)ccnc4c3c2)c(F)c1
InChIInChI=1S/C50H30F6N2O2.C48H21F11N2O2.C40H14F10N2O2.2C40H18F6N2O2/c1-27-19-28(2)21-35(20-27)33-11-13-43-41(24-33)45-47(59-43)39(15-17-57-45)31-7-3-29(4-8-31)30-5-9-32(10-6-30)40-16-18-58-46-42-25-34(12-14-44(42)60-48(40)46)36-22-37(49(51,52)53)26-38(23-36)50(54,55)56;1-20-36(49)38(51)33(39(52)37(20)50)25-10-12-31-29(18-25)44-46(62-31)27(14-16-60-44)23-6-2-21(3-7-23)22-4-8-24(9-5-22)28-15-17-61-45-30-19-26(11-13-32(30)63-47(28)45)34-40(53)42(55)35(48(57,58)59)43(56)41(34)54;41-27-25(28(42)32(46)35(49)31(27)45)17-5-7-23-21(13-17)37-39(53-23)19(9-11-51-37)15-1-2-16(4-3-15)20-10-12-52-38-22-14-18(6-8-24(22)54-40(20)38)26-29(43)33(47)36(50)34(48)30(26)44;41-23-15-29(43)35(30(44)16-23)21-5-7-33-27(13-21)37-39(49-33)25(9-11-47-37)19-1-2-20(4-3-19)26-10-12-48-38-28-14-22(6-8-34(28)50-40(26)38)36-31(45)17-24(42)18-32(36)46;41-29-15-23(16-30(42)35(29)45)21-5-7-33-27(13-21)37-39(49-33)25(9-11-47-37)19-1-2-20(4-3-19)26-10-12-48-38-28-14-22(6-8-34(28)50-40(26)38)24-17-31(43)36(46)32(44)18-24/h3-26H,1-2H3;2-19H,1H3;1-14H;2*1-18H
InChIKeyHXCYGGWJKJJMBV-UHFFFAOYSA-N
MW3761.19 g/mol
LogP66.21
Rot. Bonds22

About 4-[4-[4-[8-[3,5-bis(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-(3,5-dimethylphenyl)-[1]benzofuro[3,2-b]pyridine;8-(2,3,4,5,6-pentafluorophenyl)-4-[4-[8-(2,3,4,5,6-pentafluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;4-[4-[4-[8-(2,3,5,6-tetrafluoro-4-methylphenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridine;8-(2,4,6-trifluorophenyl)-4-[4-[8-(2,4,6-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-(3,4,5-trifluorophenyl)-4-[4-[8-(3,4,5-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine

4-[4-[4-[8-[3,5-bis(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-(3,5-dimethylphenyl)-[1]benzofuro[3,2-b]pyridine;8-(2,3,4,5,6-pentafluorophenyl)-4-[4-[8-(2,3,4,5,6-pentafluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;4-[4-[4-[8-(2,3,5,6-tetrafluoro-4-methylphenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridine;8-(2,4,6-trifluorophenyl)-4-[4-[8-(2,4,6-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-(3,4,5-trifluorophenyl)-4-[4-[8-(3,4,5-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine (PubChem CID 158613535) has the molecular formula C218H101F39N10O10 and a molecular weight of 3761.19 g/mol. Its IUPAC name is 4-[4-[4-[8-[3,5-bis(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-(3,5-dimethylphenyl)-[1]benzofuro[3,2-b]pyridine;8-(2,3,4,5,6-pentafluorophenyl)-4-[4-[8-(2,3,4,5,6-pentafluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;4-[4-[4-[8-(2,3,5,6-tetrafluoro-4-methylphenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridine;8-(2,4,6-trifluorophenyl)-4-[4-[8-(2,4,6-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-(3,4,5-trifluorophenyl)-4-[4-[8-(3,4,5-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine.

Molecular Properties

Compound Name4-[4-[4-[8-[3,5-bis(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-(3,5-dimethylphenyl)-[1]benzofuro[3,2-b]pyridine;8-(2,3,4,5,6-pentafluorophenyl)-4-[4-[8-(2,3,4,5,6-pentafluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;4-[4-[4-[8-(2,3,5,6-tetrafluoro-4-methylphenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridine;8-(2,4,6-trifluorophenyl)-4-[4-[8-(2,4,6-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-(3,4,5-trifluorophenyl)-4-[4-[8-(3,4,5-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine
PubChem CID158613535
Molecular FormulaC218H101F39N10O10
Molecular Weight3761.19 g/mol
Exact Mass3758.71
IUPAC Name4-[4-[4-[8-[3,5-bis(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-(3,5-dimethylphenyl)-[1]benzofuro[3,2-b]pyridine;8-(2,3,4,5,6-pentafluorophenyl)-4-[4-[8-(2,3,4,5,6-pentafluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;4-[4-[4-[8-(2,3,5,6-tetrafluoro-4-methylphenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridine;8-(2,4,6-trifluorophenyl)-4-[4-[8-(2,4,6-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-(3,4,5-trifluorophenyl)-4-[4-[8-(3,4,5-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine
SMILESCc1c(F)c(F)c(-c2ccc3oc4c(-c5ccc(-c6ccc(-c7ccnc8c7oc7ccc(-c9c(F)c(F)c(C(F)(F)F)c(F)c9F)cc78)cc6)cc5)ccnc4c3c2)c(F)c1F.Cc1cc(C)cc(-c2ccc3oc4c(-c5ccc(-c6ccc(-c7ccnc8c7oc7ccc(-c9cc(C(F)(F)F)cc(C(F)(F)F)c9)cc78)cc6)cc5)ccnc4c3c2)c1.Fc1c(F)c(F)c(-c2ccc3oc4c(-c5ccc(-c6ccnc7c6oc6ccc(-c8c(F)c(F)c(F)c(F)c8F)cc67)cc5)ccnc4c3c2)c(F)c1F.Fc1cc(-c2ccc3oc4c(-c5ccc(-c6ccnc7c6oc6ccc(-c8cc(F)c(F)c(F)c8)cc67)cc5)ccnc4c3c2)cc(F)c1F.Fc1cc(F)c(-c2ccc3oc4c(-c5ccc(-c6ccnc7c6oc6ccc(-c8c(F)cc(F)cc8F)cc67)cc5)ccnc4c3c2)c(F)c1
InChIInChI=1S/C50H30F6N2O2.C48H21F11N2O2.C40H14F10N2O2.2C40H18F6N2O2/c1-27-19-28(2)21-35(20-27)33-11-13-43-41(24-33)45-47(59-43)39(15-17-57-45)31-7-3-29(4-8-31)30-5-9-32(10-6-30)40-16-18-58-46-42-25-34(12-14-44(42)60-48(40)46)36-22-37(49(51,52)53)26-38(23-36)50(54,55)56;1-20-36(49)38(51)33(39(52)37(20)50)25-10-12-31-29(18-25)44-46(62-31)27(14-16-60-44)23-6-2-21(3-7-23)22-4-8-24(9-5-22)28-15-17-61-45-30-19-26(11-13-32(30)63-47(28)45)34-40(53)42(55)35(48(57,58)59)43(56)41(34)54;41-27-25(28(42)32(46)35(49)31(27)45)17-5-7-23-21(13-17)37-39(53-23)19(9-11-51-37)15-1-2-16(4-3-15)20-10-12-52-38-22-14-18(6-8-24(22)54-40(20)38)26-29(43)33(47)36(50)34(48)30(26)44;41-23-15-29(43)35(30(44)16-23)21-5-7-33-27(13-21)37-39(49-33)25(9-11-47-37)19-1-2-20(4-3-19)26-10-12-48-38-28-14-22(6-8-34(28)50-40(26)38)36-31(45)17-24(42)18-32(36)46;41-29-15-23(16-30(42)35(29)45)21-5-7-33-27(13-21)37-39(49-33)25(9-11-47-37)19-1-2-20(4-3-19)26-10-12-48-38-28-14-22(6-8-34(28)50-40(26)38)24-17-31(43)36(46)32(44)18-24/h3-26H,1-2H3;2-19H,1H3;1-14H;2*1-18H
InChIKeyHXCYGGWJKJJMBV-UHFFFAOYSA-N
XLogP66.21
TPSA260.30 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds22
Heavy Atoms277
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003761.19
LogP ≤ 566.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Analyze 4-[4-[4-[8-[3,5-bis(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-(3,5-dimethylphenyl)-[1]benzofuro[3,2-b]pyridine;8-(2,3,4,5,6-pentafluorophenyl)-4-[4-[8-(2,3,4,5,6-pentafluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;4-[4-[4-[8-(2,3,5,6-tetrafluoro-4-methylphenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridine;8-(2,4,6-trifluorophenyl)-4-[4-[8-(2,4,6-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-(3,4,5-trifluorophenyl)-4-[4-[8-(3,4,5-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine with MolForge

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Related Compounds

8-[4-(2,6-Diphenylpyridin-4-yl)phenyl]-3-(trifluoromethyl)-[1]benzofuro[3,2-b]pyridine
CID 89994807
8-[4-(9-Phenyl-1,10-phenanthrolin-2-yl)phenyl]-3-(trifluoromethyl)-[1]benzofuro[3,2-b]pyridine
CID 134411551
4-[3,5-Bis[8-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-8-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridine
CID 139573899
8-[6-[6-(2,4,6-Trifluorophenyl)-2-pyridinyl]-2-pyridinyl]-4-[4-[8-[6-[6-(2,4,6-trifluorophenyl)-2-pyridinyl]-2-pyridinyl]-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine
CID 139573900
8-(2,3,4,5,6-Pentafluorophenyl)-4-[4-[8-(2,3,4,5,6-pentafluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine
CID 142336321
8-(3,4,5-Trifluorophenyl)-4-[4-[4-[8-(3,4,5-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-[1]benzofuro[3,2-b]pyridine
CID 142336367
8-(2,4,6-Trifluorophenyl)-4-[4-[8-(2,4,6-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine
CID 142336387
4-[3,5-Bis[8-(2,3,4,5,6-pentafluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-8-(2,3,4,5,6-pentafluorophenyl)-[1]benzofuro[3,2-b]pyridine
CID 142336399
8-[2,3,5,6-Tetrafluoro-4-(trifluoromethyl)phenyl]-4-[4-[8-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine
CID 142336422
8-[5-(3,4,5-Trifluorophenyl)-2-pyridinyl]-4-[4-[8-[5-(3,4,5-trifluorophenyl)-2-pyridinyl]-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine
CID 142336427
4-[3,5-Bis[8-[3,5-bis(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-8-[3,5-bis(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridine
CID 142336440
4-[3,5-Bis[8-(3,4,5-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-8-(3,4,5-trifluorophenyl)-[1]benzofuro[3,2-b]pyridine
CID 142336482

Frequently Asked Questions

What is the IUPAC name of 4-[4-[4-[8-[3,5-bis(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-(3,5-dimethylphenyl)-[1]benzofuro[3,2-b]pyridine;8-(2,3,4,5,6-pentafluorophenyl)-4-[4-[8-(2,3,4,5,6-pentafluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;4-[4-[4-[8-(2,3,5,6-tetrafluoro-4-methylphenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridine;8-(2,4,6-trifluorophenyl)-4-[4-[8-(2,4,6-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-(3,4,5-trifluorophenyl)-4-[4-[8-(3,4,5-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine?
The IUPAC name of 4-[4-[4-[8-[3,5-bis(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-(3,5-dimethylphenyl)-[1]benzofuro[3,2-b]pyridine;8-(2,3,4,5,6-pentafluorophenyl)-4-[4-[8-(2,3,4,5,6-pentafluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;4-[4-[4-[8-(2,3,5,6-tetrafluoro-4-methylphenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridine;8-(2,4,6-trifluorophenyl)-4-[4-[8-(2,4,6-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-(3,4,5-trifluorophenyl)-4-[4-[8-(3,4,5-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine (CID 158613535) is 4-[4-[4-[8-[3,5-bis(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-(3,5-dimethylphenyl)-[1]benzofuro[3,2-b]pyridine;8-(2,3,4,5,6-pentafluorophenyl)-4-[4-[8-(2,3,4,5,6-pentafluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;4-[4-[4-[8-(2,3,5,6-tetrafluoro-4-methylphenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridine;8-(2,4,6-trifluorophenyl)-4-[4-[8-(2,4,6-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-(3,4,5-trifluorophenyl)-4-[4-[8-(3,4,5-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine.
What is the SMILES notation for 4-[4-[4-[8-[3,5-bis(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-(3,5-dimethylphenyl)-[1]benzofuro[3,2-b]pyridine;8-(2,3,4,5,6-pentafluorophenyl)-4-[4-[8-(2,3,4,5,6-pentafluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;4-[4-[4-[8-(2,3,5,6-tetrafluoro-4-methylphenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridine;8-(2,4,6-trifluorophenyl)-4-[4-[8-(2,4,6-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-(3,4,5-trifluorophenyl)-4-[4-[8-(3,4,5-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine?
The canonical SMILES for 4-[4-[4-[8-[3,5-bis(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-(3,5-dimethylphenyl)-[1]benzofuro[3,2-b]pyridine;8-(2,3,4,5,6-pentafluorophenyl)-4-[4-[8-(2,3,4,5,6-pentafluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;4-[4-[4-[8-(2,3,5,6-tetrafluoro-4-methylphenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridine;8-(2,4,6-trifluorophenyl)-4-[4-[8-(2,4,6-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-(3,4,5-trifluorophenyl)-4-[4-[8-(3,4,5-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine is Cc1c(F)c(F)c(-c2ccc3oc4c(-c5ccc(-c6ccc(-c7ccnc8c7oc7ccc(-c9c(F)c(F)c(C(F)(F)F)c(F)c9F)cc78)cc6)cc5)ccnc4c3c2)c(F)c1F.Cc1cc(C)cc(-c2ccc3oc4c(-c5ccc(-c6ccc(-c7ccnc8c7oc7ccc(-c9cc(C(F)(F)F)cc(C(F)(F)F)c9)cc78)cc6)cc5)ccnc4c3c2)c1.Fc1c(F)c(F)c(-c2ccc3oc4c(-c5ccc(-c6ccnc7c6oc6ccc(-c8c(F)c(F)c(F)c(F)c8F)cc67)cc5)ccnc4c3c2)c(F)c1F.Fc1cc(-c2ccc3oc4c(-c5ccc(-c6ccnc7c6oc6ccc(-c8cc(F)c(F)c(F)c8)cc67)cc5)ccnc4c3c2)cc(F)c1F.Fc1cc(F)c(-c2ccc3oc4c(-c5ccc(-c6ccnc7c6oc6ccc(-c8c(F)cc(F)cc8F)cc67)cc5)ccnc4c3c2)c(F)c1.
What is the InChIKey of 4-[4-[4-[8-[3,5-bis(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-(3,5-dimethylphenyl)-[1]benzofuro[3,2-b]pyridine;8-(2,3,4,5,6-pentafluorophenyl)-4-[4-[8-(2,3,4,5,6-pentafluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;4-[4-[4-[8-(2,3,5,6-tetrafluoro-4-methylphenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridine;8-(2,4,6-trifluorophenyl)-4-[4-[8-(2,4,6-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-(3,4,5-trifluorophenyl)-4-[4-[8-(3,4,5-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine?
The InChIKey is HXCYGGWJKJJMBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H30F6N2O2.C48H21F11N2O2.C40H14F10N2O2.2C40H18F6N2O2/c1-27-19-28(2)21-35(20-27)33-11-13-43-41(24-33)45-47(59-43)39(15-17-57-45)31-7-3-29(4-8-31)30-5-9-32(10-6-30)40-16-18-58-46-42-25-34(12-14-44(42)60-48(40)46)36-22-37(49(51,52)53)26-38(23-36)50(54,55)56;1-20-36(49)38(51)33(39(52)37(20)50)25-10-12-31-29(18-25)44-46(62-31)27(14-16-60-44)23-6-2-21(3-7-23)22-4-8-24(9-5-22)28-15-17-61-45-30-19-26(11-13-32(30)63-47(28)45)34-40(53)42(55)35(48(57,58)59)43(56)41(34)54;41-27-25(28(42)32(46)35(49)31(27)45)17-5-7-23-21(13-17)37-39(53-23)19(9-11-51-37)15-1-2-16(4-3-15)20-10-12-52-38-22-14-18(6-8-24(22)54-40(20)38)26-29(43)33(47)36(50)34(48)30(26)44;41-23-15-29(43)35(30(44)16-23)21-5-7-33-27(13-21)37-39(49-33)25(9-11-47-37)19-1-2-20(4-3-19)26-10-12-48-38-28-14-22(6-8-34(28)50-40(26)38)36-31(45)17-24(42)18-32(36)46;41-29-15-23(16-30(42)35(29)45)21-5-7-33-27(13-21)37-39(49-33)25(9-11-47-37)19-1-2-20(4-3-19)26-10-12-48-38-28-14-22(6-8-34(28)50-40(26)38)24-17-31(43)36(46)32(44)18-24/h3-26H,1-2H3;2-19H,1H3;1-14H;2*1-18H.
What are the key properties of 4-[4-[4-[8-[3,5-bis(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-(3,5-dimethylphenyl)-[1]benzofuro[3,2-b]pyridine;8-(2,3,4,5,6-pentafluorophenyl)-4-[4-[8-(2,3,4,5,6-pentafluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;4-[4-[4-[8-(2,3,5,6-tetrafluoro-4-methylphenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridine;8-(2,4,6-trifluorophenyl)-4-[4-[8-(2,4,6-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-(3,4,5-trifluorophenyl)-4-[4-[8-(3,4,5-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine?
4-[4-[4-[8-[3,5-bis(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-(3,5-dimethylphenyl)-[1]benzofuro[3,2-b]pyridine;8-(2,3,4,5,6-pentafluorophenyl)-4-[4-[8-(2,3,4,5,6-pentafluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;4-[4-[4-[8-(2,3,5,6-tetrafluoro-4-methylphenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridine;8-(2,4,6-trifluorophenyl)-4-[4-[8-(2,4,6-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-(3,4,5-trifluorophenyl)-4-[4-[8-(3,4,5-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine has a molecular weight of 3761.19 g/mol, XLogP of 66.21, 22 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[4-[8-[3,5-bis(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-(3,5-dimethylphenyl)-[1]benzofuro[3,2-b]pyridine;8-(2,3,4,5,6-pentafluorophenyl)-4-[4-[8-(2,3,4,5,6-pentafluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;4-[4-[4-[8-(2,3,5,6-tetrafluoro-4-methylphenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]phenyl]-8-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-[1]benzofuro[3,2-b]pyridine;8-(2,4,6-trifluorophenyl)-4-[4-[8-(2,4,6-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-(3,4,5-trifluorophenyl)-4-[4-[8-(3,4,5-trifluorophenyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine is sourced from PubChem (CID 158613535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).