potassium;2-[2,6-bis(3-bromothiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;2-[2,6-bis(3-ethynylthiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;dichloroplatinum;trimethyl-[2-[2-[2-[3-(2-trimethylsilylethynyl)thiophen-2-yl]-4,8-bis[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-6-yl]thiophen-3-yl]ethynyl]silane;hydroxide

C134H165Br2Cl2KOPtS12Si8 — CID 157251553

IUPACpotassium;2-[2,6-bis(3-bromothiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;2-[2,6-bis(3-ethynylthiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;dichloroplatinum;trimethyl-[2-[2-[2-[3-(2-trimethylsilylethynyl)thiophen-2-yl]-4,8-bis[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-6-yl]thiophen-3-yl]ethynyl]silane;hydroxide
SMILESC#Cc1ccsc1-c1cc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c3sc(-c4sccc4C#C)cc3c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2s1.CC(C)[Si](C#Cc1c2cc(-c3sccc3Br)sc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2cc(-c3sccc3Br)sc12)(C(C)C)C(C)C.CC(C)[Si](C#Cc1c2cc(-c3sccc3C#C[Si](C)(C)C)sc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2cc(-c3sccc3C#C[Si](C)(C)C)sc12)(C(C)C)C(C)C.Cl[Pt]Cl.[K+].[OH-]
InChIInChI=1S/C50H66S4Si4.C44H50S4Si2.C40H48Br2S4Si2.2ClH.K.H2O.Pt/c1-33(2)57(34(3)4,35(5)6)29-23-41-43-31-45(47-39(19-25-51-47)21-27-55(13,14)15)54-50(43)42(24-30-58(36(7)8,37(9)10)38(11)12)44-32-46(53-49(41)44)48-40(20-26-52-48)22-28-56(16,17)18;1-15-33-17-21-45-41(33)39-25-37-35(19-23-49(27(3)4,28(5)6)29(7)8)44-38(26-40(48-44)42-34(16-2)18-22-46-42)36(43(37)47-39)20-24-50(30(9)10,31(11)12)32(13)14;1-23(2)47(24(3)4,25(5)6)19-15-29-31-21-35(39-33(41)13-17-43-39)46-38(31)30(16-20-48(26(7)8,27(9)10)28(11)12)32-22-36(45-37(29)32)40-34(42)14-18-44-40;;;;;/h19-20,25-26,31-38H,1-18H3;1-2,17-18,21-22,25-32H,3-14H3;13-14,17-18,21-28H,1-12H3;2*1H;;1H2;/q;;;;;+1;;+2/p-3
InChIKeyAWKDTRQQRUYJCZ-UHFFFAOYSA-K
MW2866.17 g/mol
LogP46.29
Rot. Bonds24

About potassium;2-[2,6-bis(3-bromothiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;2-[2,6-bis(3-ethynylthiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;dichloroplatinum;trimethyl-[2-[2-[2-[3-(2-trimethylsilylethynyl)thiophen-2-yl]-4,8-bis[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-6-yl]thiophen-3-yl]ethynyl]silane;hydroxide

potassium;2-[2,6-bis(3-bromothiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;2-[2,6-bis(3-ethynylthiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;dichloroplatinum;trimethyl-[2-[2-[2-[3-(2-trimethylsilylethynyl)thiophen-2-yl]-4,8-bis[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-6-yl]thiophen-3-yl]ethynyl]silane;hydroxide (PubChem CID 157251553) has the molecular formula C134H165Br2Cl2KOPtS12Si8 and a molecular weight of 2866.17 g/mol. Its IUPAC name is potassium;2-[2,6-bis(3-bromothiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;2-[2,6-bis(3-ethynylthiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;dichloroplatinum;trimethyl-[2-[2-[2-[3-(2-trimethylsilylethynyl)thiophen-2-yl]-4,8-bis[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-6-yl]thiophen-3-yl]ethynyl]silane;hydroxide.

Molecular Properties

Compound Namepotassium;2-[2,6-bis(3-bromothiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;2-[2,6-bis(3-ethynylthiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;dichloroplatinum;trimethyl-[2-[2-[2-[3-(2-trimethylsilylethynyl)thiophen-2-yl]-4,8-bis[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-6-yl]thiophen-3-yl]ethynyl]silane;hydroxide
PubChem CID157251553
Molecular FormulaC134H165Br2Cl2KOPtS12Si8
Molecular Weight2866.17 g/mol
Exact Mass2859.47
IUPAC Namepotassium;2-[2,6-bis(3-bromothiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;2-[2,6-bis(3-ethynylthiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;dichloroplatinum;trimethyl-[2-[2-[2-[3-(2-trimethylsilylethynyl)thiophen-2-yl]-4,8-bis[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-6-yl]thiophen-3-yl]ethynyl]silane;hydroxide
SMILESC#Cc1ccsc1-c1cc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c3sc(-c4sccc4C#C)cc3c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2s1.CC(C)[Si](C#Cc1c2cc(-c3sccc3Br)sc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2cc(-c3sccc3Br)sc12)(C(C)C)C(C)C.CC(C)[Si](C#Cc1c2cc(-c3sccc3C#C[Si](C)(C)C)sc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2cc(-c3sccc3C#C[Si](C)(C)C)sc12)(C(C)C)C(C)C.Cl[Pt]Cl.[K+].[OH-]
InChIInChI=1S/C50H66S4Si4.C44H50S4Si2.C40H48Br2S4Si2.2ClH.K.H2O.Pt/c1-33(2)57(34(3)4,35(5)6)29-23-41-43-31-45(47-39(19-25-51-47)21-27-55(13,14)15)54-50(43)42(24-30-58(36(7)8,37(9)10)38(11)12)44-32-46(53-49(41)44)48-40(20-26-52-48)22-28-56(16,17)18;1-15-33-17-21-45-41(33)39-25-37-35(19-23-49(27(3)4,28(5)6)29(7)8)44-38(26-40(48-44)42-34(16-2)18-22-46-42)36(43(37)47-39)20-24-50(30(9)10,31(11)12)32(13)14;1-23(2)47(24(3)4,25(5)6)19-15-29-31-21-35(39-33(41)13-17-43-39)46-38(31)30(16-20-48(26(7)8,27(9)10)28(11)12)32-22-36(45-37(29)32)40-34(42)14-18-44-40;;;;;/h19-20,25-26,31-38H,1-18H3;1-2,17-18,21-22,25-32H,3-14H3;13-14,17-18,21-28H,1-12H3;2*1H;;1H2;/q;;;;;+1;;+2/p-3
InChIKeyAWKDTRQQRUYJCZ-UHFFFAOYSA-K
XLogP46.29
TPSA30.00 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds24
Heavy Atoms161
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002866.17
LogP ≤ 546.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze potassium;2-[2,6-bis(3-bromothiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;2-[2,6-bis(3-ethynylthiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;dichloroplatinum;trimethyl-[2-[2-[2-[3-(2-trimethylsilylethynyl)thiophen-2-yl]-4,8-bis[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-6-yl]thiophen-3-yl]ethynyl]silane;hydroxide with MolForge

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Frequently Asked Questions

What is the IUPAC name of potassium;2-[2,6-bis(3-bromothiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;2-[2,6-bis(3-ethynylthiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;dichloroplatinum;trimethyl-[2-[2-[2-[3-(2-trimethylsilylethynyl)thiophen-2-yl]-4,8-bis[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-6-yl]thiophen-3-yl]ethynyl]silane;hydroxide?
The IUPAC name of potassium;2-[2,6-bis(3-bromothiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;2-[2,6-bis(3-ethynylthiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;dichloroplatinum;trimethyl-[2-[2-[2-[3-(2-trimethylsilylethynyl)thiophen-2-yl]-4,8-bis[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-6-yl]thiophen-3-yl]ethynyl]silane;hydroxide (CID 157251553) is potassium;2-[2,6-bis(3-bromothiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;2-[2,6-bis(3-ethynylthiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;dichloroplatinum;trimethyl-[2-[2-[2-[3-(2-trimethylsilylethynyl)thiophen-2-yl]-4,8-bis[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-6-yl]thiophen-3-yl]ethynyl]silane;hydroxide.
What is the SMILES notation for potassium;2-[2,6-bis(3-bromothiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;2-[2,6-bis(3-ethynylthiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;dichloroplatinum;trimethyl-[2-[2-[2-[3-(2-trimethylsilylethynyl)thiophen-2-yl]-4,8-bis[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-6-yl]thiophen-3-yl]ethynyl]silane;hydroxide?
The canonical SMILES for potassium;2-[2,6-bis(3-bromothiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;2-[2,6-bis(3-ethynylthiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;dichloroplatinum;trimethyl-[2-[2-[2-[3-(2-trimethylsilylethynyl)thiophen-2-yl]-4,8-bis[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-6-yl]thiophen-3-yl]ethynyl]silane;hydroxide is C#Cc1ccsc1-c1cc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c3sc(-c4sccc4C#C)cc3c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2s1.CC(C)[Si](C#Cc1c2cc(-c3sccc3Br)sc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2cc(-c3sccc3Br)sc12)(C(C)C)C(C)C.CC(C)[Si](C#Cc1c2cc(-c3sccc3C#C[Si](C)(C)C)sc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2cc(-c3sccc3C#C[Si](C)(C)C)sc12)(C(C)C)C(C)C.Cl[Pt]Cl.[K+].[OH-].
What is the InChIKey of potassium;2-[2,6-bis(3-bromothiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;2-[2,6-bis(3-ethynylthiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;dichloroplatinum;trimethyl-[2-[2-[2-[3-(2-trimethylsilylethynyl)thiophen-2-yl]-4,8-bis[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-6-yl]thiophen-3-yl]ethynyl]silane;hydroxide?
The InChIKey is AWKDTRQQRUYJCZ-UHFFFAOYSA-K. The full InChI is InChI=1S/C50H66S4Si4.C44H50S4Si2.C40H48Br2S4Si2.2ClH.K.H2O.Pt/c1-33(2)57(34(3)4,35(5)6)29-23-41-43-31-45(47-39(19-25-51-47)21-27-55(13,14)15)54-50(43)42(24-30-58(36(7)8,37(9)10)38(11)12)44-32-46(53-49(41)44)48-40(20-26-52-48)22-28-56(16,17)18;1-15-33-17-21-45-41(33)39-25-37-35(19-23-49(27(3)4,28(5)6)29(7)8)44-38(26-40(48-44)42-34(16-2)18-22-46-42)36(43(37)47-39)20-24-50(30(9)10,31(11)12)32(13)14;1-23(2)47(24(3)4,25(5)6)19-15-29-31-21-35(39-33(41)13-17-43-39)46-38(31)30(16-20-48(26(7)8,27(9)10)28(11)12)32-22-36(45-37(29)32)40-34(42)14-18-44-40;;;;;/h19-20,25-26,31-38H,1-18H3;1-2,17-18,21-22,25-32H,3-14H3;13-14,17-18,21-28H,1-12H3;2*1H;;1H2;/q;;;;;+1;;+2/p-3.
What are the key properties of potassium;2-[2,6-bis(3-bromothiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;2-[2,6-bis(3-ethynylthiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;dichloroplatinum;trimethyl-[2-[2-[2-[3-(2-trimethylsilylethynyl)thiophen-2-yl]-4,8-bis[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-6-yl]thiophen-3-yl]ethynyl]silane;hydroxide?
potassium;2-[2,6-bis(3-bromothiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;2-[2,6-bis(3-ethynylthiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;dichloroplatinum;trimethyl-[2-[2-[2-[3-(2-trimethylsilylethynyl)thiophen-2-yl]-4,8-bis[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-6-yl]thiophen-3-yl]ethynyl]silane;hydroxide has a molecular weight of 2866.17 g/mol, XLogP of 46.29, 24 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;2-[2,6-bis(3-bromothiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;2-[2,6-bis(3-ethynylthiophen-2-yl)-4-[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-8-yl]ethynyl-tri(propan-2-yl)silane;dichloroplatinum;trimethyl-[2-[2-[2-[3-(2-trimethylsilylethynyl)thiophen-2-yl]-4,8-bis[2-tri(propan-2-yl)silylethynyl]thieno[2,3-f][1]benzothiol-6-yl]thiophen-3-yl]ethynyl]silane;hydroxide is sourced from PubChem (CID 157251553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).