2-[7-[4-[2-[4-[7-(1,3-benzoxazol-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9-dimethylfluoren-2-yl]-1,3-benzoxazole;2-[4-[7-[2-[7-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9-dimethylfluoren-2-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9-dimethylfluoren-2-yl]phenyl]-1,3-benzoxazole;2-[4-[7'-[2-[7'-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9'-spirobi[fluorene]-2'-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]-1,3-benzoxazole;2-[7'-[4-[2-[4-[7'-(1,3-benzoxazol-2-yl)-9,9'-spirobi[fluorene]-2'-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9'-spirobi[fluorene]-2'-yl]-1,3-benzoxazole

C304H192N16O8 — CID 158662419

IUPAC2-[7-[4-[2-[4-[7-(1,3-benzoxazol-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9-dimethylfluoren-2-yl]-1,3-benzoxazole;2-[4-[7-[2-[7-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9-dimethylfluoren-2-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9-dimethylfluoren-2-yl]phenyl]-1,3-benzoxazole;2-[4-[7'-[2-[7'-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9'-spirobi[fluorene]-2'-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]-1,3-benzoxazole;2-[7'-[4-[2-[4-[7'-(1,3-benzoxazol-2-yl)-9,9'-spirobi[fluorene]-2'-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9'-spirobi[fluorene]-2'-yl]-1,3-benzoxazole
SMILESCC1(C)c2cc(-c3ccc(-c4ccc(-c5ccccn5)nc4-c4ccc(-c5ccc6c(c5)C(C)(C)c5cc(-c7nc8ccccc8o7)ccc5-6)cc4)cc3)ccc2-c2ccc(-c3nc4ccccc4o3)cc21.CC1(C)c2cc(-c3ccc(-c4nc5ccccc5o4)cc3)ccc2-c2ccc(-c3ccc(-c4ccccn4)nc3-c3ccc4c(c3)C(C)(C)c3cc(-c5ccc(-c6nc7ccccc7o6)cc5)ccc3-4)cc21.c1ccc(-c2ccc(-c3ccc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4cc(-c6nc7ccccc7o6)ccc4-5)cc3)c(-c3ccc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4cc(-c6nc7ccccc7o6)ccc4-5)cc3)n2)nc1.c1ccc(-c2ccc(-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3cc(-c5ccc(-c6nc7ccccc7o6)cc5)ccc3-4)c(-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3cc(-c5ccc(-c6nc7ccccc7o6)cc5)ccc3-4)n2)nc1
InChIInChI=1S/2C86H50N4O2.2C66H46N4O2/c1-5-19-68-60(15-1)61-16-2-6-20-69(61)85(68)72-47-55(51-28-32-53(33-29-51)83-89-78-24-9-11-26-80(78)91-83)36-40-64(72)66-42-38-57(49-74(66)85)59-44-45-77(76-23-13-14-46-87-76)88-82(59)58-39-43-67-65-41-37-56(52-30-34-54(35-31-52)84-90-79-25-10-12-27-81(79)92-84)48-73(65)86(75(67)50-58)70-21-7-3-17-62(70)63-18-4-8-22-71(63)86;1-5-19-68-60(15-1)61-16-2-6-20-69(61)85(68)72-47-55(36-40-64(72)66-42-38-57(49-74(66)85)83-89-78-24-9-11-26-80(78)91-83)51-28-32-53(33-29-51)59-44-45-77(76-23-13-14-46-87-76)88-82(59)54-34-30-52(31-35-54)56-37-41-65-67-43-39-58(84-90-79-25-10-12-27-81(79)92-84)50-75(67)86(73(65)48-56)70-21-7-3-17-62(70)63-18-4-8-22-71(63)86;1-65(2)52-35-43(39-16-20-41(21-17-39)63-69-58-12-5-7-14-60(58)71-63)24-28-48(52)50-30-26-45(37-54(50)65)47-32-33-57(56-11-9-10-34-67-56)68-62(47)46-27-31-51-49-29-25-44(36-53(49)66(3,4)55(51)38-46)40-18-22-42(23-19-40)64-70-59-13-6-8-15-61(59)72-64;1-65(2)52-35-43(24-28-48(52)50-30-26-45(37-54(50)65)63-69-58-12-5-7-14-60(58)71-63)39-16-20-41(21-17-39)47-32-33-57(56-11-9-10-34-67-56)68-62(47)42-22-18-40(19-23-42)44-25-29-49-51-31-27-46(38-55(51)66(3,4)53(49)36-44)64-70-59-13-6-8-15-61(59)72-64/h2*1-50H;2*5-38H,1-4H3
InChIKeyICXNQFYIVQQLQB-UHFFFAOYSA-N
MW4196.98 g/mol
LogP76.31
Rot. Bonds28

About 2-[7-[4-[2-[4-[7-(1,3-benzoxazol-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9-dimethylfluoren-2-yl]-1,3-benzoxazole;2-[4-[7-[2-[7-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9-dimethylfluoren-2-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9-dimethylfluoren-2-yl]phenyl]-1,3-benzoxazole;2-[4-[7'-[2-[7'-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9'-spirobi[fluorene]-2'-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]-1,3-benzoxazole;2-[7'-[4-[2-[4-[7'-(1,3-benzoxazol-2-yl)-9,9'-spirobi[fluorene]-2'-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9'-spirobi[fluorene]-2'-yl]-1,3-benzoxazole

2-[7-[4-[2-[4-[7-(1,3-benzoxazol-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9-dimethylfluoren-2-yl]-1,3-benzoxazole;2-[4-[7-[2-[7-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9-dimethylfluoren-2-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9-dimethylfluoren-2-yl]phenyl]-1,3-benzoxazole;2-[4-[7'-[2-[7'-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9'-spirobi[fluorene]-2'-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]-1,3-benzoxazole;2-[7'-[4-[2-[4-[7'-(1,3-benzoxazol-2-yl)-9,9'-spirobi[fluorene]-2'-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9'-spirobi[fluorene]-2'-yl]-1,3-benzoxazole (PubChem CID 158662419) has the molecular formula C304H192N16O8 and a molecular weight of 4196.98 g/mol. Its IUPAC name is 2-[7-[4-[2-[4-[7-(1,3-benzoxazol-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9-dimethylfluoren-2-yl]-1,3-benzoxazole;2-[4-[7-[2-[7-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9-dimethylfluoren-2-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9-dimethylfluoren-2-yl]phenyl]-1,3-benzoxazole;2-[4-[7'-[2-[7'-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9'-spirobi[fluorene]-2'-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]-1,3-benzoxazole;2-[7'-[4-[2-[4-[7'-(1,3-benzoxazol-2-yl)-9,9'-spirobi[fluorene]-2'-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9'-spirobi[fluorene]-2'-yl]-1,3-benzoxazole.

Molecular Properties

Compound Name2-[7-[4-[2-[4-[7-(1,3-benzoxazol-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9-dimethylfluoren-2-yl]-1,3-benzoxazole;2-[4-[7-[2-[7-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9-dimethylfluoren-2-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9-dimethylfluoren-2-yl]phenyl]-1,3-benzoxazole;2-[4-[7'-[2-[7'-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9'-spirobi[fluorene]-2'-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]-1,3-benzoxazole;2-[7'-[4-[2-[4-[7'-(1,3-benzoxazol-2-yl)-9,9'-spirobi[fluorene]-2'-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9'-spirobi[fluorene]-2'-yl]-1,3-benzoxazole
PubChem CID158662419
Molecular FormulaC304H192N16O8
Molecular Weight4196.98 g/mol
Exact Mass4193.51
IUPAC Name2-[7-[4-[2-[4-[7-(1,3-benzoxazol-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9-dimethylfluoren-2-yl]-1,3-benzoxazole;2-[4-[7-[2-[7-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9-dimethylfluoren-2-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9-dimethylfluoren-2-yl]phenyl]-1,3-benzoxazole;2-[4-[7'-[2-[7'-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9'-spirobi[fluorene]-2'-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]-1,3-benzoxazole;2-[7'-[4-[2-[4-[7'-(1,3-benzoxazol-2-yl)-9,9'-spirobi[fluorene]-2'-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9'-spirobi[fluorene]-2'-yl]-1,3-benzoxazole
SMILESCC1(C)c2cc(-c3ccc(-c4ccc(-c5ccccn5)nc4-c4ccc(-c5ccc6c(c5)C(C)(C)c5cc(-c7nc8ccccc8o7)ccc5-6)cc4)cc3)ccc2-c2ccc(-c3nc4ccccc4o3)cc21.CC1(C)c2cc(-c3ccc(-c4nc5ccccc5o4)cc3)ccc2-c2ccc(-c3ccc(-c4ccccn4)nc3-c3ccc4c(c3)C(C)(C)c3cc(-c5ccc(-c6nc7ccccc7o6)cc5)ccc3-4)cc21.c1ccc(-c2ccc(-c3ccc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4cc(-c6nc7ccccc7o6)ccc4-5)cc3)c(-c3ccc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4cc(-c6nc7ccccc7o6)ccc4-5)cc3)n2)nc1.c1ccc(-c2ccc(-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3cc(-c5ccc(-c6nc7ccccc7o6)cc5)ccc3-4)c(-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3cc(-c5ccc(-c6nc7ccccc7o6)cc5)ccc3-4)n2)nc1
InChIInChI=1S/2C86H50N4O2.2C66H46N4O2/c1-5-19-68-60(15-1)61-16-2-6-20-69(61)85(68)72-47-55(51-28-32-53(33-29-51)83-89-78-24-9-11-26-80(78)91-83)36-40-64(72)66-42-38-57(49-74(66)85)59-44-45-77(76-23-13-14-46-87-76)88-82(59)58-39-43-67-65-41-37-56(52-30-34-54(35-31-52)84-90-79-25-10-12-27-81(79)92-84)48-73(65)86(75(67)50-58)70-21-7-3-17-62(70)63-18-4-8-22-71(63)86;1-5-19-68-60(15-1)61-16-2-6-20-69(61)85(68)72-47-55(36-40-64(72)66-42-38-57(49-74(66)85)83-89-78-24-9-11-26-80(78)91-83)51-28-32-53(33-29-51)59-44-45-77(76-23-13-14-46-87-76)88-82(59)54-34-30-52(31-35-54)56-37-41-65-67-43-39-58(84-90-79-25-10-12-27-81(79)92-84)50-75(67)86(73(65)48-56)70-21-7-3-17-62(70)63-18-4-8-22-71(63)86;1-65(2)52-35-43(39-16-20-41(21-17-39)63-69-58-12-5-7-14-60(58)71-63)24-28-48(52)50-30-26-45(37-54(50)65)47-32-33-57(56-11-9-10-34-67-56)68-62(47)46-27-31-51-49-29-25-44(36-53(49)66(3,4)55(51)38-46)40-18-22-42(23-19-40)64-70-59-13-6-8-15-61(59)72-64;1-65(2)52-35-43(24-28-48(52)50-30-26-45(37-54(50)65)63-69-58-12-5-7-14-60(58)71-63)39-16-20-41(21-17-39)47-32-33-57(56-11-9-10-34-67-56)68-62(47)42-22-18-40(19-23-42)44-25-29-49-51-31-27-46(38-55(51)66(3,4)53(49)36-44)64-70-59-13-6-8-15-61(59)72-64/h2*1-50H;2*5-38H,1-4H3
InChIKeyICXNQFYIVQQLQB-UHFFFAOYSA-N
XLogP76.31
TPSA311.36 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds28
Heavy Atoms328
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004196.98
LogP ≤ 576.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Analyze 2-[7-[4-[2-[4-[7-(1,3-benzoxazol-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9-dimethylfluoren-2-yl]-1,3-benzoxazole;2-[4-[7-[2-[7-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9-dimethylfluoren-2-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9-dimethylfluoren-2-yl]phenyl]-1,3-benzoxazole;2-[4-[7'-[2-[7'-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9'-spirobi[fluorene]-2'-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]-1,3-benzoxazole;2-[7'-[4-[2-[4-[7'-(1,3-benzoxazol-2-yl)-9,9'-spirobi[fluorene]-2'-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9'-spirobi[fluorene]-2'-yl]-1,3-benzoxazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[7-[4-[2-[4-[7-(1,3-benzoxazol-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9-dimethylfluoren-2-yl]-1,3-benzoxazole;2-[4-[7-[2-[7-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9-dimethylfluoren-2-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9-dimethylfluoren-2-yl]phenyl]-1,3-benzoxazole;2-[4-[7'-[2-[7'-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9'-spirobi[fluorene]-2'-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]-1,3-benzoxazole;2-[7'-[4-[2-[4-[7'-(1,3-benzoxazol-2-yl)-9,9'-spirobi[fluorene]-2'-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9'-spirobi[fluorene]-2'-yl]-1,3-benzoxazole?
The IUPAC name of 2-[7-[4-[2-[4-[7-(1,3-benzoxazol-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9-dimethylfluoren-2-yl]-1,3-benzoxazole;2-[4-[7-[2-[7-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9-dimethylfluoren-2-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9-dimethylfluoren-2-yl]phenyl]-1,3-benzoxazole;2-[4-[7'-[2-[7'-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9'-spirobi[fluorene]-2'-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]-1,3-benzoxazole;2-[7'-[4-[2-[4-[7'-(1,3-benzoxazol-2-yl)-9,9'-spirobi[fluorene]-2'-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9'-spirobi[fluorene]-2'-yl]-1,3-benzoxazole (CID 158662419) is 2-[7-[4-[2-[4-[7-(1,3-benzoxazol-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9-dimethylfluoren-2-yl]-1,3-benzoxazole;2-[4-[7-[2-[7-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9-dimethylfluoren-2-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9-dimethylfluoren-2-yl]phenyl]-1,3-benzoxazole;2-[4-[7'-[2-[7'-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9'-spirobi[fluorene]-2'-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]-1,3-benzoxazole;2-[7'-[4-[2-[4-[7'-(1,3-benzoxazol-2-yl)-9,9'-spirobi[fluorene]-2'-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9'-spirobi[fluorene]-2'-yl]-1,3-benzoxazole.
What is the SMILES notation for 2-[7-[4-[2-[4-[7-(1,3-benzoxazol-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9-dimethylfluoren-2-yl]-1,3-benzoxazole;2-[4-[7-[2-[7-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9-dimethylfluoren-2-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9-dimethylfluoren-2-yl]phenyl]-1,3-benzoxazole;2-[4-[7'-[2-[7'-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9'-spirobi[fluorene]-2'-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]-1,3-benzoxazole;2-[7'-[4-[2-[4-[7'-(1,3-benzoxazol-2-yl)-9,9'-spirobi[fluorene]-2'-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9'-spirobi[fluorene]-2'-yl]-1,3-benzoxazole?
The canonical SMILES for 2-[7-[4-[2-[4-[7-(1,3-benzoxazol-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9-dimethylfluoren-2-yl]-1,3-benzoxazole;2-[4-[7-[2-[7-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9-dimethylfluoren-2-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9-dimethylfluoren-2-yl]phenyl]-1,3-benzoxazole;2-[4-[7'-[2-[7'-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9'-spirobi[fluorene]-2'-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]-1,3-benzoxazole;2-[7'-[4-[2-[4-[7'-(1,3-benzoxazol-2-yl)-9,9'-spirobi[fluorene]-2'-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9'-spirobi[fluorene]-2'-yl]-1,3-benzoxazole is CC1(C)c2cc(-c3ccc(-c4ccc(-c5ccccn5)nc4-c4ccc(-c5ccc6c(c5)C(C)(C)c5cc(-c7nc8ccccc8o7)ccc5-6)cc4)cc3)ccc2-c2ccc(-c3nc4ccccc4o3)cc21.CC1(C)c2cc(-c3ccc(-c4nc5ccccc5o4)cc3)ccc2-c2ccc(-c3ccc(-c4ccccn4)nc3-c3ccc4c(c3)C(C)(C)c3cc(-c5ccc(-c6nc7ccccc7o6)cc5)ccc3-4)cc21.c1ccc(-c2ccc(-c3ccc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4cc(-c6nc7ccccc7o6)ccc4-5)cc3)c(-c3ccc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4cc(-c6nc7ccccc7o6)ccc4-5)cc3)n2)nc1.c1ccc(-c2ccc(-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3cc(-c5ccc(-c6nc7ccccc7o6)cc5)ccc3-4)c(-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3cc(-c5ccc(-c6nc7ccccc7o6)cc5)ccc3-4)n2)nc1.
What is the InChIKey of 2-[7-[4-[2-[4-[7-(1,3-benzoxazol-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9-dimethylfluoren-2-yl]-1,3-benzoxazole;2-[4-[7-[2-[7-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9-dimethylfluoren-2-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9-dimethylfluoren-2-yl]phenyl]-1,3-benzoxazole;2-[4-[7'-[2-[7'-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9'-spirobi[fluorene]-2'-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]-1,3-benzoxazole;2-[7'-[4-[2-[4-[7'-(1,3-benzoxazol-2-yl)-9,9'-spirobi[fluorene]-2'-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9'-spirobi[fluorene]-2'-yl]-1,3-benzoxazole?
The InChIKey is ICXNQFYIVQQLQB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C86H50N4O2.2C66H46N4O2/c1-5-19-68-60(15-1)61-16-2-6-20-69(61)85(68)72-47-55(51-28-32-53(33-29-51)83-89-78-24-9-11-26-80(78)91-83)36-40-64(72)66-42-38-57(49-74(66)85)59-44-45-77(76-23-13-14-46-87-76)88-82(59)58-39-43-67-65-41-37-56(52-30-34-54(35-31-52)84-90-79-25-10-12-27-81(79)92-84)48-73(65)86(75(67)50-58)70-21-7-3-17-62(70)63-18-4-8-22-71(63)86;1-5-19-68-60(15-1)61-16-2-6-20-69(61)85(68)72-47-55(36-40-64(72)66-42-38-57(49-74(66)85)83-89-78-24-9-11-26-80(78)91-83)51-28-32-53(33-29-51)59-44-45-77(76-23-13-14-46-87-76)88-82(59)54-34-30-52(31-35-54)56-37-41-65-67-43-39-58(84-90-79-25-10-12-27-81(79)92-84)50-75(67)86(73(65)48-56)70-21-7-3-17-62(70)63-18-4-8-22-71(63)86;1-65(2)52-35-43(39-16-20-41(21-17-39)63-69-58-12-5-7-14-60(58)71-63)24-28-48(52)50-30-26-45(37-54(50)65)47-32-33-57(56-11-9-10-34-67-56)68-62(47)46-27-31-51-49-29-25-44(36-53(49)66(3,4)55(51)38-46)40-18-22-42(23-19-40)64-70-59-13-6-8-15-61(59)72-64;1-65(2)52-35-43(24-28-48(52)50-30-26-45(37-54(50)65)63-69-58-12-5-7-14-60(58)71-63)39-16-20-41(21-17-39)47-32-33-57(56-11-9-10-34-67-56)68-62(47)42-22-18-40(19-23-42)44-25-29-49-51-31-27-46(38-55(51)66(3,4)53(49)36-44)64-70-59-13-6-8-15-61(59)72-64/h2*1-50H;2*5-38H,1-4H3.
What are the key properties of 2-[7-[4-[2-[4-[7-(1,3-benzoxazol-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9-dimethylfluoren-2-yl]-1,3-benzoxazole;2-[4-[7-[2-[7-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9-dimethylfluoren-2-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9-dimethylfluoren-2-yl]phenyl]-1,3-benzoxazole;2-[4-[7'-[2-[7'-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9'-spirobi[fluorene]-2'-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]-1,3-benzoxazole;2-[7'-[4-[2-[4-[7'-(1,3-benzoxazol-2-yl)-9,9'-spirobi[fluorene]-2'-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9'-spirobi[fluorene]-2'-yl]-1,3-benzoxazole?
2-[7-[4-[2-[4-[7-(1,3-benzoxazol-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9-dimethylfluoren-2-yl]-1,3-benzoxazole;2-[4-[7-[2-[7-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9-dimethylfluoren-2-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9-dimethylfluoren-2-yl]phenyl]-1,3-benzoxazole;2-[4-[7'-[2-[7'-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9'-spirobi[fluorene]-2'-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]-1,3-benzoxazole;2-[7'-[4-[2-[4-[7'-(1,3-benzoxazol-2-yl)-9,9'-spirobi[fluorene]-2'-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9'-spirobi[fluorene]-2'-yl]-1,3-benzoxazole has a molecular weight of 4196.98 g/mol, XLogP of 76.31, 28 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[7-[4-[2-[4-[7-(1,3-benzoxazol-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9-dimethylfluoren-2-yl]-1,3-benzoxazole;2-[4-[7-[2-[7-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9-dimethylfluoren-2-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9-dimethylfluoren-2-yl]phenyl]-1,3-benzoxazole;2-[4-[7'-[2-[7'-[4-(1,3-benzoxazol-2-yl)phenyl]-9,9'-spirobi[fluorene]-2'-yl]-6-pyridin-2-yl-3-pyridinyl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]-1,3-benzoxazole;2-[7'-[4-[2-[4-[7'-(1,3-benzoxazol-2-yl)-9,9'-spirobi[fluorene]-2'-yl]phenyl]-6-pyridin-2-yl-3-pyridinyl]phenyl]-9,9'-spirobi[fluorene]-2'-yl]-1,3-benzoxazole is sourced from PubChem (CID 158662419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).