2-carbazol-9-yl-4-[2-[4-[2-(5-carbazol-9-yl-4-hydroxythiophen-3-yl)phenoxy]butoxy]phenyl]thiophen-3-ol;2-(2,6-ditert-butylanthracen-9-yl)-4-[2-[4-[2-[5-(2,6-ditert-butylanthracen-9-yl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-(3,5-ditert-butylphenyl)-4-[2-[4-[2-[5-(3,5-ditert-butylphenyl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;4-(3,5-ditert-butylphenyl)-2-[2-[4-[2-[4-(3,5-ditert-butylphenyl)-3-hydroxythiophen-2-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-(2,4,6-trimethylphenyl)thiophen-2-yl]phenoxy]butoxy]phenyl]-4-(2,4,6-trimethylphenyl)thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-2-yl]phenoxy]butoxy]phenyl]-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-3-ol

C316H338N2O24S12 — CID 162155207

IUPAC2-carbazol-9-yl-4-[2-[4-[2-(5-carbazol-9-yl-4-hydroxythiophen-3-yl)phenoxy]butoxy]phenyl]thiophen-3-ol;2-(2,6-ditert-butylanthracen-9-yl)-4-[2-[4-[2-[5-(2,6-ditert-butylanthracen-9-yl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-(3,5-ditert-butylphenyl)-4-[2-[4-[2-[5-(3,5-ditert-butylphenyl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;4-(3,5-ditert-butylphenyl)-2-[2-[4-[2-[4-(3,5-ditert-butylphenyl)-3-hydroxythiophen-2-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-(2,4,6-trimethylphenyl)thiophen-2-yl]phenoxy]butoxy]phenyl]-4-(2,4,6-trimethylphenyl)thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-2-yl]phenoxy]butoxy]phenyl]-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-3-ol
SMILESCC(C)(C)c1cc(-c2csc(-c3ccccc3OCCCCOc3ccccc3-c3scc(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c3O)c2O)cc(C(C)(C)C)c1.CC(C)(C)c1cc(-c2scc(-c3ccccc3OCCCCOc3ccccc3-c3csc(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c3O)c2O)cc(C(C)(C)C)c1.CC(C)(C)c1ccc2c(-c3scc(-c4ccccc4OCCCCOc4ccccc4-c4csc(-c5c6ccc(C(C)(C)C)cc6cc6ccc(C(C)(C)C)cc56)c4O)c3O)c3cc(C(C)(C)C)ccc3cc2c1.CC(C)c1cc(C(C)C)c(-c2csc(-c3ccccc3OCCCCOc3ccccc3-c3scc(-c4c(C(C)C)cc(C(C)C)cc4C(C)C)c3O)c2O)c(C(C)C)c1.Cc1cc(C)c(-c2csc(-c3ccccc3OCCCCOc3ccccc3-c3scc(-c4c(C)cc(C)cc4C)c3O)c2O)c(C)c1.Oc1c(-c2ccccc2OCCCCOc2ccccc2-c2csc(-n3c4ccccc4c4ccccc43)c2O)csc1-n1c2ccccc2c2ccccc21
InChIInChI=1S/C68H70O4S2.C54H66O4S2.2C52H62O4S2.C48H36N2O4S2.C42H42O4S2/c1-65(2,3)45-27-29-49-43(35-45)33-41-23-25-47(67(7,8)9)37-53(41)59(49)63-61(69)55(39-73-63)51-19-13-15-21-57(51)71-31-17-18-32-72-58-22-16-14-20-52(58)56-40-74-64(62(56)70)60-50-30-28-46(66(4,5)6)36-44(50)34-42-24-26-48(38-54(42)60)68(10,11)12;1-31(2)37-25-41(33(5)6)49(42(26-37)34(7)8)45-29-59-53(51(45)55)39-19-13-15-21-47(39)57-23-17-18-24-58-48-22-16-14-20-40(48)54-52(56)46(30-60-54)50-43(35(9)10)27-38(32(3)4)28-44(50)36(11)12;1-49(2,3)35-25-33(26-36(29-35)50(4,5)6)47-45(53)41(31-57-47)39-19-13-15-21-43(39)55-23-17-18-24-56-44-22-16-14-20-40(44)42-32-58-48(46(42)54)34-27-37(51(7,8)9)30-38(28-34)52(10,11)12;1-49(2,3)35-25-33(26-36(29-35)50(4,5)6)41-31-57-47(45(41)53)39-19-13-15-21-43(39)55-23-17-18-24-56-44-22-16-14-20-40(44)48-46(54)42(32-58-48)34-27-37(51(7,8)9)30-38(28-34)52(10,11)12;51-45-37(29-55-47(45)49-39-21-7-1-15-31(39)32-16-2-8-22-40(32)49)35-19-5-11-25-43(35)53-27-13-14-28-54-44-26-12-6-20-36(44)38-30-56-48(46(38)52)50-41-23-9-3-17-33(41)34-18-4-10-24-42(34)50;1-25-19-27(3)37(28(4)20-25)33-23-47-41(39(33)43)31-13-7-9-15-35(31)45-17-11-12-18-46-36-16-10-8-14-32(36)42-40(44)34(24-48-42)38-29(5)21-26(2)22-30(38)6/h13-16,19-30,33-40,69-70H,17-18,31-32H2,1-12H3;13-16,19-22,25-36,55-56H,17-18,23-24H2,1-12H3;2*13-16,19-22,25-32,53-54H,17-18,23-24H2,1-12H3;1-12,15-26,29-30,51-52H,13-14,27-28H2;7-10,13-16,19-24,43-44H,11-12,17-18H2,1-6H3
InChIKeyZLSSGCXUOSKVBD-UHFFFAOYSA-N
MW4932.97 g/mol
LogP92.39
Rot. Bonds72

About 2-carbazol-9-yl-4-[2-[4-[2-(5-carbazol-9-yl-4-hydroxythiophen-3-yl)phenoxy]butoxy]phenyl]thiophen-3-ol;2-(2,6-ditert-butylanthracen-9-yl)-4-[2-[4-[2-[5-(2,6-ditert-butylanthracen-9-yl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-(3,5-ditert-butylphenyl)-4-[2-[4-[2-[5-(3,5-ditert-butylphenyl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;4-(3,5-ditert-butylphenyl)-2-[2-[4-[2-[4-(3,5-ditert-butylphenyl)-3-hydroxythiophen-2-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-(2,4,6-trimethylphenyl)thiophen-2-yl]phenoxy]butoxy]phenyl]-4-(2,4,6-trimethylphenyl)thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-2-yl]phenoxy]butoxy]phenyl]-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-3-ol

2-carbazol-9-yl-4-[2-[4-[2-(5-carbazol-9-yl-4-hydroxythiophen-3-yl)phenoxy]butoxy]phenyl]thiophen-3-ol;2-(2,6-ditert-butylanthracen-9-yl)-4-[2-[4-[2-[5-(2,6-ditert-butylanthracen-9-yl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-(3,5-ditert-butylphenyl)-4-[2-[4-[2-[5-(3,5-ditert-butylphenyl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;4-(3,5-ditert-butylphenyl)-2-[2-[4-[2-[4-(3,5-ditert-butylphenyl)-3-hydroxythiophen-2-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-(2,4,6-trimethylphenyl)thiophen-2-yl]phenoxy]butoxy]phenyl]-4-(2,4,6-trimethylphenyl)thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-2-yl]phenoxy]butoxy]phenyl]-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-3-ol (PubChem CID 162155207) has the molecular formula C316H338N2O24S12 and a molecular weight of 4932.97 g/mol. Its IUPAC name is 2-carbazol-9-yl-4-[2-[4-[2-(5-carbazol-9-yl-4-hydroxythiophen-3-yl)phenoxy]butoxy]phenyl]thiophen-3-ol;2-(2,6-ditert-butylanthracen-9-yl)-4-[2-[4-[2-[5-(2,6-ditert-butylanthracen-9-yl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-(3,5-ditert-butylphenyl)-4-[2-[4-[2-[5-(3,5-ditert-butylphenyl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;4-(3,5-ditert-butylphenyl)-2-[2-[4-[2-[4-(3,5-ditert-butylphenyl)-3-hydroxythiophen-2-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-(2,4,6-trimethylphenyl)thiophen-2-yl]phenoxy]butoxy]phenyl]-4-(2,4,6-trimethylphenyl)thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-2-yl]phenoxy]butoxy]phenyl]-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-3-ol.

Molecular Properties

Compound Name2-carbazol-9-yl-4-[2-[4-[2-(5-carbazol-9-yl-4-hydroxythiophen-3-yl)phenoxy]butoxy]phenyl]thiophen-3-ol;2-(2,6-ditert-butylanthracen-9-yl)-4-[2-[4-[2-[5-(2,6-ditert-butylanthracen-9-yl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-(3,5-ditert-butylphenyl)-4-[2-[4-[2-[5-(3,5-ditert-butylphenyl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;4-(3,5-ditert-butylphenyl)-2-[2-[4-[2-[4-(3,5-ditert-butylphenyl)-3-hydroxythiophen-2-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-(2,4,6-trimethylphenyl)thiophen-2-yl]phenoxy]butoxy]phenyl]-4-(2,4,6-trimethylphenyl)thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-2-yl]phenoxy]butoxy]phenyl]-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-3-ol
PubChem CID162155207
Molecular FormulaC316H338N2O24S12
Molecular Weight4932.97 g/mol
Exact Mass4928.19
IUPAC Name2-carbazol-9-yl-4-[2-[4-[2-(5-carbazol-9-yl-4-hydroxythiophen-3-yl)phenoxy]butoxy]phenyl]thiophen-3-ol;2-(2,6-ditert-butylanthracen-9-yl)-4-[2-[4-[2-[5-(2,6-ditert-butylanthracen-9-yl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-(3,5-ditert-butylphenyl)-4-[2-[4-[2-[5-(3,5-ditert-butylphenyl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;4-(3,5-ditert-butylphenyl)-2-[2-[4-[2-[4-(3,5-ditert-butylphenyl)-3-hydroxythiophen-2-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-(2,4,6-trimethylphenyl)thiophen-2-yl]phenoxy]butoxy]phenyl]-4-(2,4,6-trimethylphenyl)thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-2-yl]phenoxy]butoxy]phenyl]-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-3-ol
SMILESCC(C)(C)c1cc(-c2csc(-c3ccccc3OCCCCOc3ccccc3-c3scc(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c3O)c2O)cc(C(C)(C)C)c1.CC(C)(C)c1cc(-c2scc(-c3ccccc3OCCCCOc3ccccc3-c3csc(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c3O)c2O)cc(C(C)(C)C)c1.CC(C)(C)c1ccc2c(-c3scc(-c4ccccc4OCCCCOc4ccccc4-c4csc(-c5c6ccc(C(C)(C)C)cc6cc6ccc(C(C)(C)C)cc56)c4O)c3O)c3cc(C(C)(C)C)ccc3cc2c1.CC(C)c1cc(C(C)C)c(-c2csc(-c3ccccc3OCCCCOc3ccccc3-c3scc(-c4c(C(C)C)cc(C(C)C)cc4C(C)C)c3O)c2O)c(C(C)C)c1.Cc1cc(C)c(-c2csc(-c3ccccc3OCCCCOc3ccccc3-c3scc(-c4c(C)cc(C)cc4C)c3O)c2O)c(C)c1.Oc1c(-c2ccccc2OCCCCOc2ccccc2-c2csc(-n3c4ccccc4c4ccccc43)c2O)csc1-n1c2ccccc2c2ccccc21
InChIInChI=1S/C68H70O4S2.C54H66O4S2.2C52H62O4S2.C48H36N2O4S2.C42H42O4S2/c1-65(2,3)45-27-29-49-43(35-45)33-41-23-25-47(67(7,8)9)37-53(41)59(49)63-61(69)55(39-73-63)51-19-13-15-21-57(51)71-31-17-18-32-72-58-22-16-14-20-52(58)56-40-74-64(62(56)70)60-50-30-28-46(66(4,5)6)36-44(50)34-42-24-26-48(38-54(42)60)68(10,11)12;1-31(2)37-25-41(33(5)6)49(42(26-37)34(7)8)45-29-59-53(51(45)55)39-19-13-15-21-47(39)57-23-17-18-24-58-48-22-16-14-20-40(48)54-52(56)46(30-60-54)50-43(35(9)10)27-38(32(3)4)28-44(50)36(11)12;1-49(2,3)35-25-33(26-36(29-35)50(4,5)6)47-45(53)41(31-57-47)39-19-13-15-21-43(39)55-23-17-18-24-56-44-22-16-14-20-40(44)42-32-58-48(46(42)54)34-27-37(51(7,8)9)30-38(28-34)52(10,11)12;1-49(2,3)35-25-33(26-36(29-35)50(4,5)6)41-31-57-47(45(41)53)39-19-13-15-21-43(39)55-23-17-18-24-56-44-22-16-14-20-40(44)48-46(54)42(32-58-48)34-27-37(51(7,8)9)30-38(28-34)52(10,11)12;51-45-37(29-55-47(45)49-39-21-7-1-15-31(39)32-16-2-8-22-40(32)49)35-19-5-11-25-43(35)53-27-13-14-28-54-44-26-12-6-20-36(44)38-30-56-48(46(38)52)50-41-23-9-3-17-33(41)34-18-4-10-24-42(34)50;1-25-19-27(3)37(28(4)20-25)33-23-47-41(39(33)43)31-13-7-9-15-35(31)45-17-11-12-18-46-36-16-10-8-14-32(36)42-40(44)34(24-48-42)38-29(5)21-26(2)22-30(38)6/h13-16,19-30,33-40,69-70H,17-18,31-32H2,1-12H3;13-16,19-22,25-36,55-56H,17-18,23-24H2,1-12H3;2*13-16,19-22,25-32,53-54H,17-18,23-24H2,1-12H3;1-12,15-26,29-30,51-52H,13-14,27-28H2;7-10,13-16,19-24,43-44H,11-12,17-18H2,1-6H3
InChIKeyZLSSGCXUOSKVBD-UHFFFAOYSA-N
XLogP92.39
TPSA363.38 Ų
H-Bond Donors12
H-Bond Acceptors38
Rotatable Bonds72
Heavy Atoms354
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004932.97
LogP ≤ 592.39
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1038

Analyze 2-carbazol-9-yl-4-[2-[4-[2-(5-carbazol-9-yl-4-hydroxythiophen-3-yl)phenoxy]butoxy]phenyl]thiophen-3-ol;2-(2,6-ditert-butylanthracen-9-yl)-4-[2-[4-[2-[5-(2,6-ditert-butylanthracen-9-yl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-(3,5-ditert-butylphenyl)-4-[2-[4-[2-[5-(3,5-ditert-butylphenyl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;4-(3,5-ditert-butylphenyl)-2-[2-[4-[2-[4-(3,5-ditert-butylphenyl)-3-hydroxythiophen-2-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-(2,4,6-trimethylphenyl)thiophen-2-yl]phenoxy]butoxy]phenyl]-4-(2,4,6-trimethylphenyl)thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-2-yl]phenoxy]butoxy]phenyl]-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-3-ol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-carbazol-9-yl-4-[2-[4-[2-(5-carbazol-9-yl-4-hydroxythiophen-3-yl)phenoxy]butoxy]phenyl]thiophen-3-ol;2-(2,6-ditert-butylanthracen-9-yl)-4-[2-[4-[2-[5-(2,6-ditert-butylanthracen-9-yl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-(3,5-ditert-butylphenyl)-4-[2-[4-[2-[5-(3,5-ditert-butylphenyl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;4-(3,5-ditert-butylphenyl)-2-[2-[4-[2-[4-(3,5-ditert-butylphenyl)-3-hydroxythiophen-2-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-(2,4,6-trimethylphenyl)thiophen-2-yl]phenoxy]butoxy]phenyl]-4-(2,4,6-trimethylphenyl)thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-2-yl]phenoxy]butoxy]phenyl]-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-3-ol?
The IUPAC name of 2-carbazol-9-yl-4-[2-[4-[2-(5-carbazol-9-yl-4-hydroxythiophen-3-yl)phenoxy]butoxy]phenyl]thiophen-3-ol;2-(2,6-ditert-butylanthracen-9-yl)-4-[2-[4-[2-[5-(2,6-ditert-butylanthracen-9-yl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-(3,5-ditert-butylphenyl)-4-[2-[4-[2-[5-(3,5-ditert-butylphenyl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;4-(3,5-ditert-butylphenyl)-2-[2-[4-[2-[4-(3,5-ditert-butylphenyl)-3-hydroxythiophen-2-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-(2,4,6-trimethylphenyl)thiophen-2-yl]phenoxy]butoxy]phenyl]-4-(2,4,6-trimethylphenyl)thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-2-yl]phenoxy]butoxy]phenyl]-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-3-ol (CID 162155207) is 2-carbazol-9-yl-4-[2-[4-[2-(5-carbazol-9-yl-4-hydroxythiophen-3-yl)phenoxy]butoxy]phenyl]thiophen-3-ol;2-(2,6-ditert-butylanthracen-9-yl)-4-[2-[4-[2-[5-(2,6-ditert-butylanthracen-9-yl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-(3,5-ditert-butylphenyl)-4-[2-[4-[2-[5-(3,5-ditert-butylphenyl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;4-(3,5-ditert-butylphenyl)-2-[2-[4-[2-[4-(3,5-ditert-butylphenyl)-3-hydroxythiophen-2-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-(2,4,6-trimethylphenyl)thiophen-2-yl]phenoxy]butoxy]phenyl]-4-(2,4,6-trimethylphenyl)thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-2-yl]phenoxy]butoxy]phenyl]-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-3-ol.
What is the SMILES notation for 2-carbazol-9-yl-4-[2-[4-[2-(5-carbazol-9-yl-4-hydroxythiophen-3-yl)phenoxy]butoxy]phenyl]thiophen-3-ol;2-(2,6-ditert-butylanthracen-9-yl)-4-[2-[4-[2-[5-(2,6-ditert-butylanthracen-9-yl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-(3,5-ditert-butylphenyl)-4-[2-[4-[2-[5-(3,5-ditert-butylphenyl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;4-(3,5-ditert-butylphenyl)-2-[2-[4-[2-[4-(3,5-ditert-butylphenyl)-3-hydroxythiophen-2-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-(2,4,6-trimethylphenyl)thiophen-2-yl]phenoxy]butoxy]phenyl]-4-(2,4,6-trimethylphenyl)thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-2-yl]phenoxy]butoxy]phenyl]-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-3-ol?
The canonical SMILES for 2-carbazol-9-yl-4-[2-[4-[2-(5-carbazol-9-yl-4-hydroxythiophen-3-yl)phenoxy]butoxy]phenyl]thiophen-3-ol;2-(2,6-ditert-butylanthracen-9-yl)-4-[2-[4-[2-[5-(2,6-ditert-butylanthracen-9-yl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-(3,5-ditert-butylphenyl)-4-[2-[4-[2-[5-(3,5-ditert-butylphenyl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;4-(3,5-ditert-butylphenyl)-2-[2-[4-[2-[4-(3,5-ditert-butylphenyl)-3-hydroxythiophen-2-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-(2,4,6-trimethylphenyl)thiophen-2-yl]phenoxy]butoxy]phenyl]-4-(2,4,6-trimethylphenyl)thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-2-yl]phenoxy]butoxy]phenyl]-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-3-ol is CC(C)(C)c1cc(-c2csc(-c3ccccc3OCCCCOc3ccccc3-c3scc(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c3O)c2O)cc(C(C)(C)C)c1.CC(C)(C)c1cc(-c2scc(-c3ccccc3OCCCCOc3ccccc3-c3csc(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c3O)c2O)cc(C(C)(C)C)c1.CC(C)(C)c1ccc2c(-c3scc(-c4ccccc4OCCCCOc4ccccc4-c4csc(-c5c6ccc(C(C)(C)C)cc6cc6ccc(C(C)(C)C)cc56)c4O)c3O)c3cc(C(C)(C)C)ccc3cc2c1.CC(C)c1cc(C(C)C)c(-c2csc(-c3ccccc3OCCCCOc3ccccc3-c3scc(-c4c(C(C)C)cc(C(C)C)cc4C(C)C)c3O)c2O)c(C(C)C)c1.Cc1cc(C)c(-c2csc(-c3ccccc3OCCCCOc3ccccc3-c3scc(-c4c(C)cc(C)cc4C)c3O)c2O)c(C)c1.Oc1c(-c2ccccc2OCCCCOc2ccccc2-c2csc(-n3c4ccccc4c4ccccc43)c2O)csc1-n1c2ccccc2c2ccccc21.
What is the InChIKey of 2-carbazol-9-yl-4-[2-[4-[2-(5-carbazol-9-yl-4-hydroxythiophen-3-yl)phenoxy]butoxy]phenyl]thiophen-3-ol;2-(2,6-ditert-butylanthracen-9-yl)-4-[2-[4-[2-[5-(2,6-ditert-butylanthracen-9-yl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-(3,5-ditert-butylphenyl)-4-[2-[4-[2-[5-(3,5-ditert-butylphenyl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;4-(3,5-ditert-butylphenyl)-2-[2-[4-[2-[4-(3,5-ditert-butylphenyl)-3-hydroxythiophen-2-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-(2,4,6-trimethylphenyl)thiophen-2-yl]phenoxy]butoxy]phenyl]-4-(2,4,6-trimethylphenyl)thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-2-yl]phenoxy]butoxy]phenyl]-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-3-ol?
The InChIKey is ZLSSGCXUOSKVBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H70O4S2.C54H66O4S2.2C52H62O4S2.C48H36N2O4S2.C42H42O4S2/c1-65(2,3)45-27-29-49-43(35-45)33-41-23-25-47(67(7,8)9)37-53(41)59(49)63-61(69)55(39-73-63)51-19-13-15-21-57(51)71-31-17-18-32-72-58-22-16-14-20-52(58)56-40-74-64(62(56)70)60-50-30-28-46(66(4,5)6)36-44(50)34-42-24-26-48(38-54(42)60)68(10,11)12;1-31(2)37-25-41(33(5)6)49(42(26-37)34(7)8)45-29-59-53(51(45)55)39-19-13-15-21-47(39)57-23-17-18-24-58-48-22-16-14-20-40(48)54-52(56)46(30-60-54)50-43(35(9)10)27-38(32(3)4)28-44(50)36(11)12;1-49(2,3)35-25-33(26-36(29-35)50(4,5)6)47-45(53)41(31-57-47)39-19-13-15-21-43(39)55-23-17-18-24-56-44-22-16-14-20-40(44)42-32-58-48(46(42)54)34-27-37(51(7,8)9)30-38(28-34)52(10,11)12;1-49(2,3)35-25-33(26-36(29-35)50(4,5)6)41-31-57-47(45(41)53)39-19-13-15-21-43(39)55-23-17-18-24-56-44-22-16-14-20-40(44)48-46(54)42(32-58-48)34-27-37(51(7,8)9)30-38(28-34)52(10,11)12;51-45-37(29-55-47(45)49-39-21-7-1-15-31(39)32-16-2-8-22-40(32)49)35-19-5-11-25-43(35)53-27-13-14-28-54-44-26-12-6-20-36(44)38-30-56-48(46(38)52)50-41-23-9-3-17-33(41)34-18-4-10-24-42(34)50;1-25-19-27(3)37(28(4)20-25)33-23-47-41(39(33)43)31-13-7-9-15-35(31)45-17-11-12-18-46-36-16-10-8-14-32(36)42-40(44)34(24-48-42)38-29(5)21-26(2)22-30(38)6/h13-16,19-30,33-40,69-70H,17-18,31-32H2,1-12H3;13-16,19-22,25-36,55-56H,17-18,23-24H2,1-12H3;2*13-16,19-22,25-32,53-54H,17-18,23-24H2,1-12H3;1-12,15-26,29-30,51-52H,13-14,27-28H2;7-10,13-16,19-24,43-44H,11-12,17-18H2,1-6H3.
What are the key properties of 2-carbazol-9-yl-4-[2-[4-[2-(5-carbazol-9-yl-4-hydroxythiophen-3-yl)phenoxy]butoxy]phenyl]thiophen-3-ol;2-(2,6-ditert-butylanthracen-9-yl)-4-[2-[4-[2-[5-(2,6-ditert-butylanthracen-9-yl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-(3,5-ditert-butylphenyl)-4-[2-[4-[2-[5-(3,5-ditert-butylphenyl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;4-(3,5-ditert-butylphenyl)-2-[2-[4-[2-[4-(3,5-ditert-butylphenyl)-3-hydroxythiophen-2-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-(2,4,6-trimethylphenyl)thiophen-2-yl]phenoxy]butoxy]phenyl]-4-(2,4,6-trimethylphenyl)thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-2-yl]phenoxy]butoxy]phenyl]-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-3-ol?
2-carbazol-9-yl-4-[2-[4-[2-(5-carbazol-9-yl-4-hydroxythiophen-3-yl)phenoxy]butoxy]phenyl]thiophen-3-ol;2-(2,6-ditert-butylanthracen-9-yl)-4-[2-[4-[2-[5-(2,6-ditert-butylanthracen-9-yl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-(3,5-ditert-butylphenyl)-4-[2-[4-[2-[5-(3,5-ditert-butylphenyl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;4-(3,5-ditert-butylphenyl)-2-[2-[4-[2-[4-(3,5-ditert-butylphenyl)-3-hydroxythiophen-2-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-(2,4,6-trimethylphenyl)thiophen-2-yl]phenoxy]butoxy]phenyl]-4-(2,4,6-trimethylphenyl)thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-2-yl]phenoxy]butoxy]phenyl]-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-3-ol has a molecular weight of 4932.97 g/mol, XLogP of 92.39, 72 rotatable bonds, 12 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 2-carbazol-9-yl-4-[2-[4-[2-(5-carbazol-9-yl-4-hydroxythiophen-3-yl)phenoxy]butoxy]phenyl]thiophen-3-ol;2-(2,6-ditert-butylanthracen-9-yl)-4-[2-[4-[2-[5-(2,6-ditert-butylanthracen-9-yl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-(3,5-ditert-butylphenyl)-4-[2-[4-[2-[5-(3,5-ditert-butylphenyl)-4-hydroxythiophen-3-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;4-(3,5-ditert-butylphenyl)-2-[2-[4-[2-[4-(3,5-ditert-butylphenyl)-3-hydroxythiophen-2-yl]phenoxy]butoxy]phenyl]thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-(2,4,6-trimethylphenyl)thiophen-2-yl]phenoxy]butoxy]phenyl]-4-(2,4,6-trimethylphenyl)thiophen-3-ol;2-[2-[4-[2-[3-hydroxy-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-2-yl]phenoxy]butoxy]phenyl]-4-[2,4,6-tri(propan-2-yl)phenyl]thiophen-3-ol is sourced from PubChem (CID 162155207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).