N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3'-phenyl-9,9'-spirobi[fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3,9,9-triphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-3'-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)-9,9'-spirobi[fluorene]-2'-amine

C222H141N3S3 — CID 158679524

IUPACN-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3'-phenyl-9,9'-spirobi[fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3,9,9-triphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-3'-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)-9,9'-spirobi[fluorene]-2'-amine
SMILESc1ccc(-c2cc3c(cc2N(c2ccc(-c4ccc5sc6ccccc6c5c4)cc2)c2ccc4c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-4)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)cc1.c1ccc(-c2cc3c(cc2N(c2ccc(-c4ccc5sc6ccccc6c5c4)cc2)c2ccc4c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-4)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)cc1.c1ccc(-c2cc3c(cc2N(c2ccc(-c4ccc5sc6ccccc6c5c4)cc2)c2ccc4c(c2)C2(c5ccccc5-c5ccccc52)c2ccccc2-4)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)cc1
InChIInChI=1S/C74H45NS.C74H47NS.C74H49NS/c1-2-18-47(19-3-1)59-44-60-56-25-9-16-32-67(56)74(64-29-13-6-22-53(64)54-23-7-14-30-65(54)74)69(60)45-70(59)75(49-37-34-46(35-38-49)48-36-41-72-61(42-48)58-26-10-17-33-71(58)76-72)50-39-40-57-55-24-8-15-31-66(55)73(68(57)43-50)62-27-11-4-20-51(62)52-21-5-12-28-63(52)73;1-4-20-49(21-5-1)61-46-62-58-29-13-18-34-67(58)74(65-32-16-11-26-55(65)56-27-12-17-33-66(56)74)69(62)47-70(61)75(53-39-36-48(37-40-53)50-38-43-72-63(44-50)60-30-14-19-35-71(60)76-72)54-41-42-59-57-28-10-15-31-64(57)73(68(59)45-54,51-22-6-2-7-23-51)52-24-8-3-9-25-52;1-6-22-51(23-7-1)63-48-64-60-33-17-20-36-67(60)74(55-28-12-4-13-29-55,56-30-14-5-15-31-56)69(64)49-70(63)75(57-41-38-50(39-42-57)52-40-45-72-65(46-52)62-34-18-21-37-71(62)76-72)58-43-44-61-59-32-16-19-35-66(59)73(68(61)47-58,53-24-8-2-9-25-53)54-26-10-3-11-27-54/h1-45H;1-47H;1-49H
InChIKeyIEYCQCDEWYNNPY-UHFFFAOYSA-N
MW2946.79 g/mol
LogP58.69
Rot. Bonds21

About N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3'-phenyl-9,9'-spirobi[fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3,9,9-triphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-3'-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)-9,9'-spirobi[fluorene]-2'-amine

N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3'-phenyl-9,9'-spirobi[fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3,9,9-triphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-3'-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)-9,9'-spirobi[fluorene]-2'-amine (PubChem CID 158679524) has the molecular formula C222H141N3S3 and a molecular weight of 2946.79 g/mol. Its IUPAC name is N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3'-phenyl-9,9'-spirobi[fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3,9,9-triphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-3'-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)-9,9'-spirobi[fluorene]-2'-amine.

Molecular Properties

Compound NameN-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3'-phenyl-9,9'-spirobi[fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3,9,9-triphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-3'-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)-9,9'-spirobi[fluorene]-2'-amine
PubChem CID158679524
Molecular FormulaC222H141N3S3
Molecular Weight2946.79 g/mol
Exact Mass2944.03
IUPAC NameN-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3'-phenyl-9,9'-spirobi[fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3,9,9-triphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-3'-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)-9,9'-spirobi[fluorene]-2'-amine
SMILESc1ccc(-c2cc3c(cc2N(c2ccc(-c4ccc5sc6ccccc6c5c4)cc2)c2ccc4c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-4)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)cc1.c1ccc(-c2cc3c(cc2N(c2ccc(-c4ccc5sc6ccccc6c5c4)cc2)c2ccc4c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-4)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)cc1.c1ccc(-c2cc3c(cc2N(c2ccc(-c4ccc5sc6ccccc6c5c4)cc2)c2ccc4c(c2)C2(c5ccccc5-c5ccccc52)c2ccccc2-4)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)cc1
InChIInChI=1S/C74H45NS.C74H47NS.C74H49NS/c1-2-18-47(19-3-1)59-44-60-56-25-9-16-32-67(56)74(64-29-13-6-22-53(64)54-23-7-14-30-65(54)74)69(60)45-70(59)75(49-37-34-46(35-38-49)48-36-41-72-61(42-48)58-26-10-17-33-71(58)76-72)50-39-40-57-55-24-8-15-31-66(55)73(68(57)43-50)62-27-11-4-20-51(62)52-21-5-12-28-63(52)73;1-4-20-49(21-5-1)61-46-62-58-29-13-18-34-67(58)74(65-32-16-11-26-55(65)56-27-12-17-33-66(56)74)69(62)47-70(61)75(53-39-36-48(37-40-53)50-38-43-72-63(44-50)60-30-14-19-35-71(60)76-72)54-41-42-59-57-28-10-15-31-64(57)73(68(59)45-54,51-22-6-2-7-23-51)52-24-8-3-9-25-52;1-6-22-51(23-7-1)63-48-64-60-33-17-20-36-67(60)74(55-28-12-4-13-29-55,56-30-14-5-15-31-56)69(64)49-70(63)75(57-41-38-50(39-42-57)52-40-45-72-65(46-52)62-34-18-21-37-71(62)76-72)58-43-44-61-59-32-16-19-35-66(59)73(68(61)47-58,53-24-8-2-9-25-53)54-26-10-3-11-27-54/h1-45H;1-47H;1-49H
InChIKeyIEYCQCDEWYNNPY-UHFFFAOYSA-N
XLogP58.69
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds21
Heavy Atoms228
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002946.79
LogP ≤ 558.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3'-phenyl-9,9'-spirobi[fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3,9,9-triphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-3'-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)-9,9'-spirobi[fluorene]-2'-amine with MolForge

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Related Compounds

N-(9,9-diphenylfluoren-2-yl)-N-[4-phenyl-2-(4-phenylphenyl)phenyl]dibenzothiophen-2-amine
CID 122675267
N-(9,9-diphenylfluoren-2-yl)-N-(2,4-diphenylphenyl)dibenzothiophen-2-amine
CID 122675269
N-(4-dibenzothiophen-4-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3,9,9-triphenylfluoren-2-amine
CID 153433797
N-[9,9-diphenyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)fluoren-2-yl]-N-(4-phenylphenyl)dibenzothiophen-2-amine
CID 170447579
N-(4-dibenzothiophen-4-ylphenyl)-N-(2,5-diphenylphenyl)-9,9-diphenylfluoren-2-amine
CID 122675334
N-(4-dibenzothiophen-2-ylphenyl)-N-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 139404238
9,9-bis(4-tert-butylphenyl)-N-(4-dibenzothiophen-2-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 122675379
N-(4-dibenzothiophen-4-ylphenyl)-N-(2,4-diphenylphenyl)-9,9-diphenylfluoren-2-amine
CID 122675309
N-(4-dibenzothiophen-2-ylphenyl)-2-[3-(9,9-diphenylfluoren-3-yl)phenyl]-N-(4-phenylphenyl)aniline
CID 168840050
N-(3-dibenzothiophen-2-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]-9,9'-spirobi[fluorene]-3-amine
CID 121381508
N-(2-phenylphenyl)-N-(4-phenylphenyl)spiro[fluoreno[2,3-b][1]benzothiole-7,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-11'-amine
CID 130463372
5-(3-dibenzothiophen-2-ylphenyl)-1-N,3-N-diphenyl-1-N-(4-phenylphenyl)-3-N-(9,9'-spirobi[fluorene]-2-yl)benzene-1,3-diamine
CID 134471524

Frequently Asked Questions

What is the IUPAC name of N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3'-phenyl-9,9'-spirobi[fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3,9,9-triphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-3'-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)-9,9'-spirobi[fluorene]-2'-amine?
The IUPAC name of N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3'-phenyl-9,9'-spirobi[fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3,9,9-triphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-3'-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)-9,9'-spirobi[fluorene]-2'-amine (CID 158679524) is N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3'-phenyl-9,9'-spirobi[fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3,9,9-triphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-3'-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)-9,9'-spirobi[fluorene]-2'-amine.
What is the SMILES notation for N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3'-phenyl-9,9'-spirobi[fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3,9,9-triphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-3'-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)-9,9'-spirobi[fluorene]-2'-amine?
The canonical SMILES for N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3'-phenyl-9,9'-spirobi[fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3,9,9-triphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-3'-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)-9,9'-spirobi[fluorene]-2'-amine is c1ccc(-c2cc3c(cc2N(c2ccc(-c4ccc5sc6ccccc6c5c4)cc2)c2ccc4c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-4)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)cc1.c1ccc(-c2cc3c(cc2N(c2ccc(-c4ccc5sc6ccccc6c5c4)cc2)c2ccc4c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-4)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)cc1.c1ccc(-c2cc3c(cc2N(c2ccc(-c4ccc5sc6ccccc6c5c4)cc2)c2ccc4c(c2)C2(c5ccccc5-c5ccccc52)c2ccccc2-4)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)cc1.
What is the InChIKey of N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3'-phenyl-9,9'-spirobi[fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3,9,9-triphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-3'-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)-9,9'-spirobi[fluorene]-2'-amine?
The InChIKey is IEYCQCDEWYNNPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H45NS.C74H47NS.C74H49NS/c1-2-18-47(19-3-1)59-44-60-56-25-9-16-32-67(56)74(64-29-13-6-22-53(64)54-23-7-14-30-65(54)74)69(60)45-70(59)75(49-37-34-46(35-38-49)48-36-41-72-61(42-48)58-26-10-17-33-71(58)76-72)50-39-40-57-55-24-8-15-31-66(55)73(68(57)43-50)62-27-11-4-20-51(62)52-21-5-12-28-63(52)73;1-4-20-49(21-5-1)61-46-62-58-29-13-18-34-67(58)74(65-32-16-11-26-55(65)56-27-12-17-33-66(56)74)69(62)47-70(61)75(53-39-36-48(37-40-53)50-38-43-72-63(44-50)60-30-14-19-35-71(60)76-72)54-41-42-59-57-28-10-15-31-64(57)73(68(59)45-54,51-22-6-2-7-23-51)52-24-8-3-9-25-52;1-6-22-51(23-7-1)63-48-64-60-33-17-20-36-67(60)74(55-28-12-4-13-29-55,56-30-14-5-15-31-56)69(64)49-70(63)75(57-41-38-50(39-42-57)52-40-45-72-65(46-52)62-34-18-21-37-71(62)76-72)58-43-44-61-59-32-16-19-35-66(59)73(68(61)47-58,53-24-8-2-9-25-53)54-26-10-3-11-27-54/h1-45H;1-47H;1-49H.
What are the key properties of N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3'-phenyl-9,9'-spirobi[fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3,9,9-triphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-3'-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)-9,9'-spirobi[fluorene]-2'-amine?
N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3'-phenyl-9,9'-spirobi[fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3,9,9-triphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-3'-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)-9,9'-spirobi[fluorene]-2'-amine has a molecular weight of 2946.79 g/mol, XLogP of 58.69, 21 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3'-phenyl-9,9'-spirobi[fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-3,9,9-triphenylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-3'-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)-9,9'-spirobi[fluorene]-2'-amine is sourced from PubChem (CID 158679524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).