11-[10-(3,4-diphenylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene

C290H170O2S6 — CID 164974984

IUPAC11-[10-(3,4-diphenylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene
SMILESc1ccc(-c2c3ccccc3c(-c3cc4cc(-c5c6ccccc6c(-c6ccc(-c7ccc8ccccc8c7)cc6)c6ccccc56)c5oc6ccccc6c5c4c4c3oc3ccccc34)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3cc4cc(-c5c6ccccc6c(-c6cccc(-c7ccc8ccccc8c7)c6)c6ccccc56)c5sc6ccccc6c5c4c4c3sc3ccccc34)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3cc4cc(-c5c6ccccc6c(-c6cccc(-c7cccc8ccccc78)c6)c6ccccc56)c5sc6ccccc6c5c4c4c3sc3ccccc34)c3ccccc23)cc1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4cc5cc(-c6c7ccccc7c(-c7ccccc7)c7ccccc67)c6sc7ccccc7c6c5c5c4sc4ccccc45)c4ccccc34)cc2-c2ccccc2)cc1
InChIInChI=1S/C74H44S2.C72H42O2.2C72H42S2/c1-4-22-45(23-5-1)50-41-40-48(42-61(50)46-24-6-2-7-25-46)67-53-30-12-16-34-57(53)70(58-35-17-13-31-54(58)67)63-44-49-43-62(69-55-32-14-10-28-51(55)66(47-26-8-3-9-27-47)52-29-11-15-33-56(52)69)73-71(59-36-18-20-38-64(59)75-73)68(49)72-60-37-19-21-39-65(60)76-74(63)72;1-2-19-45(20-3-1)64-50-22-6-10-26-54(50)67(55-27-11-7-23-51(55)64)60-41-49-42-61(72-70(59-31-15-17-33-63(59)74-72)66(49)69-58-30-14-16-32-62(58)73-71(60)69)68-56-28-12-8-24-52(56)65(53-25-9-13-29-57(53)68)46-37-34-44(35-38-46)48-39-36-43-18-4-5-21-47(43)40-48;1-2-21-44(22-3-1)64-50-27-6-10-31-54(50)67(55-32-11-7-28-51(55)64)60-41-47-42-61(72-70(59-36-15-17-39-63(59)74-72)66(47)69-58-35-14-16-38-62(58)73-71(60)69)68-56-33-12-8-29-52(56)65(53-30-9-13-34-57(53)68)46-25-18-24-45(40-46)49-37-19-23-43-20-4-5-26-48(43)49;1-2-20-44(21-3-1)64-50-25-6-10-29-54(50)67(55-30-11-7-26-51(55)64)60-41-49-42-61(72-70(59-34-15-17-36-63(59)74-72)66(49)69-58-33-14-16-35-62(58)73-71(60)69)68-56-31-12-8-27-52(56)65(53-28-9-13-32-57(53)68)48-24-18-23-46(40-48)47-38-37-43-19-4-5-22-45(43)39-47/h1-44H;3*1-42H
InChIKeyDQOLANVBROORTG-UHFFFAOYSA-N
MW3878.95 g/mol
LogP86.28
Rot. Bonds21

About 11-[10-(3,4-diphenylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene

11-[10-(3,4-diphenylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene (PubChem CID 164974984) has the molecular formula C290H170O2S6 and a molecular weight of 3878.95 g/mol. Its IUPAC name is 11-[10-(3,4-diphenylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene.

Molecular Properties

Compound Name11-[10-(3,4-diphenylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene
PubChem CID164974984
Molecular FormulaC290H170O2S6
Molecular Weight3878.95 g/mol
Exact Mass3875.15
IUPAC Name11-[10-(3,4-diphenylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene
SMILESc1ccc(-c2c3ccccc3c(-c3cc4cc(-c5c6ccccc6c(-c6ccc(-c7ccc8ccccc8c7)cc6)c6ccccc56)c5oc6ccccc6c5c4c4c3oc3ccccc34)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3cc4cc(-c5c6ccccc6c(-c6cccc(-c7ccc8ccccc8c7)c6)c6ccccc56)c5sc6ccccc6c5c4c4c3sc3ccccc34)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3cc4cc(-c5c6ccccc6c(-c6cccc(-c7cccc8ccccc78)c6)c6ccccc56)c5sc6ccccc6c5c4c4c3sc3ccccc34)c3ccccc23)cc1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4cc5cc(-c6c7ccccc7c(-c7ccccc7)c7ccccc67)c6sc7ccccc7c6c5c5c4sc4ccccc45)c4ccccc34)cc2-c2ccccc2)cc1
InChIInChI=1S/C74H44S2.C72H42O2.2C72H42S2/c1-4-22-45(23-5-1)50-41-40-48(42-61(50)46-24-6-2-7-25-46)67-53-30-12-16-34-57(53)70(58-35-17-13-31-54(58)67)63-44-49-43-62(69-55-32-14-10-28-51(55)66(47-26-8-3-9-27-47)52-29-11-15-33-56(52)69)73-71(59-36-18-20-38-64(59)75-73)68(49)72-60-37-19-21-39-65(60)76-74(63)72;1-2-19-45(20-3-1)64-50-22-6-10-26-54(50)67(55-27-11-7-23-51(55)64)60-41-49-42-61(72-70(59-31-15-17-33-63(59)74-72)66(49)69-58-30-14-16-32-62(58)73-71(60)69)68-56-28-12-8-24-52(56)65(53-25-9-13-29-57(53)68)46-37-34-44(35-38-46)48-39-36-43-18-4-5-21-47(43)40-48;1-2-21-44(22-3-1)64-50-27-6-10-31-54(50)67(55-32-11-7-28-51(55)64)60-41-47-42-61(72-70(59-36-15-17-39-63(59)74-72)66(47)69-58-35-14-16-38-62(58)73-71(60)69)68-56-33-12-8-29-52(56)65(53-30-9-13-34-57(53)68)46-25-18-24-45(40-46)49-37-19-23-43-20-4-5-26-48(43)49;1-2-20-44(21-3-1)64-50-25-6-10-29-54(50)67(55-30-11-7-26-51(55)64)60-41-49-42-61(72-70(59-34-15-17-36-63(59)74-72)66(49)69-58-33-14-16-35-62(58)73-71(60)69)68-56-31-12-8-27-52(56)65(53-28-9-13-32-57(53)68)48-24-18-23-46(40-48)47-38-37-43-19-4-5-22-45(43)39-47/h1-44H;3*1-42H
InChIKeyDQOLANVBROORTG-UHFFFAOYSA-N
XLogP86.28
TPSA26.28 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds21
Heavy Atoms298
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003878.95
LogP ≤ 586.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 11-[10-(3,4-diphenylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 11-[10-(3,4-diphenylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene?
The IUPAC name of 11-[10-(3,4-diphenylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene (CID 164974984) is 11-[10-(3,4-diphenylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene.
What is the SMILES notation for 11-[10-(3,4-diphenylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene?
The canonical SMILES for 11-[10-(3,4-diphenylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene is c1ccc(-c2c3ccccc3c(-c3cc4cc(-c5c6ccccc6c(-c6ccc(-c7ccc8ccccc8c7)cc6)c6ccccc56)c5oc6ccccc6c5c4c4c3oc3ccccc34)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3cc4cc(-c5c6ccccc6c(-c6cccc(-c7ccc8ccccc8c7)c6)c6ccccc56)c5sc6ccccc6c5c4c4c3sc3ccccc34)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3cc4cc(-c5c6ccccc6c(-c6cccc(-c7cccc8ccccc78)c6)c6ccccc56)c5sc6ccccc6c5c4c4c3sc3ccccc34)c3ccccc23)cc1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4cc5cc(-c6c7ccccc7c(-c7ccccc7)c7ccccc67)c6sc7ccccc7c6c5c5c4sc4ccccc45)c4ccccc34)cc2-c2ccccc2)cc1.
What is the InChIKey of 11-[10-(3,4-diphenylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene?
The InChIKey is DQOLANVBROORTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H44S2.C72H42O2.2C72H42S2/c1-4-22-45(23-5-1)50-41-40-48(42-61(50)46-24-6-2-7-25-46)67-53-30-12-16-34-57(53)70(58-35-17-13-31-54(58)67)63-44-49-43-62(69-55-32-14-10-28-51(55)66(47-26-8-3-9-27-47)52-29-11-15-33-56(52)69)73-71(59-36-18-20-38-64(59)75-73)68(49)72-60-37-19-21-39-65(60)76-74(63)72;1-2-19-45(20-3-1)64-50-22-6-10-26-54(50)67(55-27-11-7-23-51(55)64)60-41-49-42-61(72-70(59-31-15-17-33-63(59)74-72)66(49)69-58-30-14-16-32-62(58)73-71(60)69)68-56-28-12-8-24-52(56)65(53-25-9-13-29-57(53)68)46-37-34-44(35-38-46)48-39-36-43-18-4-5-21-47(43)40-48;1-2-21-44(22-3-1)64-50-27-6-10-31-54(50)67(55-32-11-7-28-51(55)64)60-41-47-42-61(72-70(59-36-15-17-39-63(59)74-72)66(47)69-58-35-14-16-38-62(58)73-71(60)69)68-56-33-12-8-29-52(56)65(53-30-9-13-34-57(53)68)46-25-18-24-45(40-46)49-37-19-23-43-20-4-5-26-48(43)49;1-2-20-44(21-3-1)64-50-25-6-10-29-54(50)67(55-30-11-7-26-51(55)64)60-41-49-42-61(72-70(59-34-15-17-36-63(59)74-72)66(49)69-58-33-14-16-35-62(58)73-71(60)69)68-56-31-12-8-27-52(56)65(53-28-9-13-32-57(53)68)48-24-18-23-46(40-48)47-38-37-43-19-4-5-22-45(43)39-47/h1-44H;3*1-42H.
What are the key properties of 11-[10-(3,4-diphenylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene?
11-[10-(3,4-diphenylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene has a molecular weight of 3878.95 g/mol, XLogP of 86.28, 21 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 11-[10-(3,4-diphenylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dioxahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene;11-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]-15-(10-phenylanthracen-9-yl)-9,17-dithiahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(24),2(10),3,5,7,11,13,15,18,20,22-undecaene is sourced from PubChem (CID 164974984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).