N,10-diphenyl-N-[6-[9-(N-phenylanilino)dibenzothiophen-2-yl]dibenzothiophen-2-yl]spiro[acridine-9,9'-fluorene]-3-amine;N-phenyl-N-[4-[9-(N-phenylanilino)dibenzofuran-2-yl]phenyl]spiro[fluorene-9,9'-xanthene]-2-amine;N-phenyl-7-[4-(N-phenylanilino)phenyl]-N-spiro[fluorene-9,9'-thioxanthene]-2'-yldibenzofuran-3-amine

C195H127N7O3S3 — CID 159384046

IUPACN,10-diphenyl-N-[6-[9-(N-phenylanilino)dibenzothiophen-2-yl]dibenzothiophen-2-yl]spiro[acridine-9,9'-fluorene]-3-amine;N-phenyl-N-[4-[9-(N-phenylanilino)dibenzofuran-2-yl]phenyl]spiro[fluorene-9,9'-xanthene]-2-amine;N-phenyl-7-[4-(N-phenylanilino)phenyl]-N-spiro[fluorene-9,9'-thioxanthene]-2'-yldibenzofuran-3-amine
SMILESc1ccc(N(c2ccc(-c3ccc4oc5cccc(N(c6ccccc6)c6ccccc6)c5c4c3)cc2)c2ccc3c(c2)C2(c4ccccc4Oc4ccccc42)c2ccccc2-3)cc1.c1ccc(N(c2ccc3c(c2)N(c2ccccc2)c2ccccc2C32c3ccccc3-c3ccccc32)c2ccc3sc4c(-c5ccc6sc7cccc(N(c8ccccc8)c8ccccc8)c7c6c5)cccc4c3c2)cc1.c1ccc(N(c2ccccc2)c2ccc(-c3ccc4c(c3)oc3cc(N(c5ccccc5)c5ccc6c(c5)C5(c7ccccc7S6)c6ccccc6-c6ccccc65)ccc34)cc2)cc1
InChIInChI=1S/C73H47N3S2.C61H40N2O2.C61H40N2OS/c1-5-21-49(22-6-1)74(54-40-42-64-67(47-54)76(52-27-11-4-12-28-52)65-36-18-17-35-63(65)73(64)61-33-15-13-29-56(61)57-30-14-16-34-62(57)73)53-41-44-68-59(46-53)58-32-19-31-55(72(58)78-68)48-39-43-69-60(45-48)71-66(37-20-38-70(71)77-69)75(50-23-7-2-8-24-50)51-25-9-3-10-26-51;1-4-17-43(18-5-1)62(47-36-37-49-48-23-10-11-24-51(48)61(54(49)40-47)52-25-12-14-28-57(52)65-58-29-15-13-26-53(58)61)46-34-31-41(32-35-46)42-33-38-56-50(39-42)60-55(27-16-30-59(60)64-56)63(44-19-6-2-7-20-44)45-21-8-3-9-22-45;1-4-16-43(17-5-1)62(44-18-6-2-7-19-44)46-31-28-41(29-32-46)42-30-35-51-52-36-33-48(40-58(52)64-57(51)38-42)63(45-20-8-3-9-21-45)47-34-37-60-56(39-47)61(55-26-14-15-27-59(55)65-60)53-24-12-10-22-49(53)50-23-11-13-25-54(50)61/h1-47H;2*1-40H
InChIKeyLLGSXKAGXOVUTQ-UHFFFAOYSA-N
MW2712.41 g/mol
LogP54.86
Rot. Bonds22

About N,10-diphenyl-N-[6-[9-(N-phenylanilino)dibenzothiophen-2-yl]dibenzothiophen-2-yl]spiro[acridine-9,9'-fluorene]-3-amine;N-phenyl-N-[4-[9-(N-phenylanilino)dibenzofuran-2-yl]phenyl]spiro[fluorene-9,9'-xanthene]-2-amine;N-phenyl-7-[4-(N-phenylanilino)phenyl]-N-spiro[fluorene-9,9'-thioxanthene]-2'-yldibenzofuran-3-amine

N,10-diphenyl-N-[6-[9-(N-phenylanilino)dibenzothiophen-2-yl]dibenzothiophen-2-yl]spiro[acridine-9,9'-fluorene]-3-amine;N-phenyl-N-[4-[9-(N-phenylanilino)dibenzofuran-2-yl]phenyl]spiro[fluorene-9,9'-xanthene]-2-amine;N-phenyl-7-[4-(N-phenylanilino)phenyl]-N-spiro[fluorene-9,9'-thioxanthene]-2'-yldibenzofuran-3-amine (PubChem CID 159384046) has the molecular formula C195H127N7O3S3 and a molecular weight of 2712.41 g/mol. Its IUPAC name is N,10-diphenyl-N-[6-[9-(N-phenylanilino)dibenzothiophen-2-yl]dibenzothiophen-2-yl]spiro[acridine-9,9'-fluorene]-3-amine;N-phenyl-N-[4-[9-(N-phenylanilino)dibenzofuran-2-yl]phenyl]spiro[fluorene-9,9'-xanthene]-2-amine;N-phenyl-7-[4-(N-phenylanilino)phenyl]-N-spiro[fluorene-9,9'-thioxanthene]-2'-yldibenzofuran-3-amine.

Molecular Properties

Compound NameN,10-diphenyl-N-[6-[9-(N-phenylanilino)dibenzothiophen-2-yl]dibenzothiophen-2-yl]spiro[acridine-9,9'-fluorene]-3-amine;N-phenyl-N-[4-[9-(N-phenylanilino)dibenzofuran-2-yl]phenyl]spiro[fluorene-9,9'-xanthene]-2-amine;N-phenyl-7-[4-(N-phenylanilino)phenyl]-N-spiro[fluorene-9,9'-thioxanthene]-2'-yldibenzofuran-3-amine
PubChem CID159384046
Molecular FormulaC195H127N7O3S3
Molecular Weight2712.41 g/mol
Exact Mass2709.92
IUPAC NameN,10-diphenyl-N-[6-[9-(N-phenylanilino)dibenzothiophen-2-yl]dibenzothiophen-2-yl]spiro[acridine-9,9'-fluorene]-3-amine;N-phenyl-N-[4-[9-(N-phenylanilino)dibenzofuran-2-yl]phenyl]spiro[fluorene-9,9'-xanthene]-2-amine;N-phenyl-7-[4-(N-phenylanilino)phenyl]-N-spiro[fluorene-9,9'-thioxanthene]-2'-yldibenzofuran-3-amine
SMILESc1ccc(N(c2ccc(-c3ccc4oc5cccc(N(c6ccccc6)c6ccccc6)c5c4c3)cc2)c2ccc3c(c2)C2(c4ccccc4Oc4ccccc42)c2ccccc2-3)cc1.c1ccc(N(c2ccc3c(c2)N(c2ccccc2)c2ccccc2C32c3ccccc3-c3ccccc32)c2ccc3sc4c(-c5ccc6sc7cccc(N(c8ccccc8)c8ccccc8)c7c6c5)cccc4c3c2)cc1.c1ccc(N(c2ccccc2)c2ccc(-c3ccc4c(c3)oc3cc(N(c5ccccc5)c5ccc6c(c5)C5(c7ccccc7S6)c6ccccc6-c6ccccc65)ccc34)cc2)cc1
InChIInChI=1S/C73H47N3S2.C61H40N2O2.C61H40N2OS/c1-5-21-49(22-6-1)74(54-40-42-64-67(47-54)76(52-27-11-4-12-28-52)65-36-18-17-35-63(65)73(64)61-33-15-13-29-56(61)57-30-14-16-34-62(57)73)53-41-44-68-59(46-53)58-32-19-31-55(72(58)78-68)48-39-43-69-60(45-48)71-66(37-20-38-70(71)77-69)75(50-23-7-2-8-24-50)51-25-9-3-10-26-51;1-4-17-43(18-5-1)62(47-36-37-49-48-23-10-11-24-51(48)61(54(49)40-47)52-25-12-14-28-57(52)65-58-29-15-13-26-53(58)61)46-34-31-41(32-35-46)42-33-38-56-50(39-42)60-55(27-16-30-59(60)64-56)63(44-19-6-2-7-20-44)45-21-8-3-9-22-45;1-4-16-43(17-5-1)62(44-18-6-2-7-19-44)46-31-28-41(29-32-46)42-30-35-51-52-36-33-48(40-58(52)64-57(51)38-42)63(45-20-8-3-9-21-45)47-34-37-60-56(39-47)61(55-26-14-15-27-59(55)65-60)53-24-12-10-22-49(53)50-23-11-13-25-54(50)61/h1-47H;2*1-40H
InChIKeyLLGSXKAGXOVUTQ-UHFFFAOYSA-N
XLogP54.86
TPSA58.19 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds22
Heavy Atoms208
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002712.41
LogP ≤ 554.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Analyze N,10-diphenyl-N-[6-[9-(N-phenylanilino)dibenzothiophen-2-yl]dibenzothiophen-2-yl]spiro[acridine-9,9'-fluorene]-3-amine;N-phenyl-N-[4-[9-(N-phenylanilino)dibenzofuran-2-yl]phenyl]spiro[fluorene-9,9'-xanthene]-2-amine;N-phenyl-7-[4-(N-phenylanilino)phenyl]-N-spiro[fluorene-9,9'-thioxanthene]-2'-yldibenzofuran-3-amine with MolForge

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Related Compounds

N,10-diphenyl-N-[3-[6-(N-phenylanilino)dibenzofuran-2-yl]phenyl]spiro[acridine-9,9'-fluorene]-3'-amine;N,10-diphenyl-N-[6-[9-(N-phenylanilino)dibenzothiophen-2-yl]dibenzothiophen-2-yl]spiro[acridine-9,9'-fluorene]-3-amine;methane;N-phenyl-N-[4-[9-(N-phenylanilino)dibenzofuran-2-yl]phenyl]spiro[fluorene-9,9'-xanthene]-2-amine;N-phenyl-N-[4-[6-(N-phenylanilino)dibenzothiophen-4-yl]phenyl]spiro[fluorene-9,9'-xanthene]-3-amine;N-phenyl-N-[4-[8-(N-phenylanilino)dibenzothiophen-3-yl]phenyl]spiro[fluorene-9,9'-xanthene]-4-amine;N-phenyl-N-[8-[4-(N-phenylanilino)naphthalen-1-yl]dibenzothiophen-2-yl]spiro[fluorene-9,9'-thioxanthene]-4-amine;N-phenyl-7-[4-(N-phenylanilino)naphthalen-1-yl]-N-spiro[fluorene-9,9'-thioxanthene]-2-yldibenzofuran-3-amine
CID 159834770
N,10-diphenyl-N-[3-[6-(N-phenylanilino)dibenzofuran-2-yl]phenyl]spiro[acridine-9,9'-fluorene]-3'-amine;N-phenyl-N-[4-[8-(N-phenylanilino)dibenzothiophen-3-yl]phenyl]spiro[fluorene-9,9'-xanthene]-4-amine;N-phenyl-N-[8-[4-(N-phenylanilino)naphthalen-1-yl]dibenzothiophen-2-yl]spiro[fluorene-9,9'-thioxanthene]-4-amine
CID 158704633
N-dibenzothiophen-2-yl-N-spiro[fluorene-9,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-thioxanthene]-2-amine;N-dibenzothiophen-4-yl-N-spiro[fluorene-9,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-thioxanthene]-2-amine;N,N-di(spiro[fluorene-9,9'-thioxanthene]-2-yl)dibenzofuran-3-amine
CID 159914253
1-N,8-N,8-N-triphenyl-1-N-(10-phenylspiro[acridine-9,9'-fluorene]-3-yl)dibenzofuran-1,8-diamine
CID 155483433
N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine
CID 158809478
N-(3-dibenzothiophen-2-ylphenyl)-10-phenyl-N-(4-phenylphenyl)spiro[acridine-9,9'-fluorene]-2'-amine
CID 155240364
N-dibenzothiophen-4-yl-10-phenyl-N-(4-phenylphenyl)spiro[acridine-9,9'-fluorene]-2'-amine
CID 147879368
N-(4-dibenzofuran-1-ylphenyl)-N-spiro[fluorene-9,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-xanthene]-3-amine;N-(4-dibenzothiophen-1-ylphenyl)-N-spiro[fluorene-9,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-xanthene]-3-amine;N-(4-dibenzothiophen-3-ylphenyl)-N-spiro[fluorene-9,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-xanthene]-3-amine;N-naphthalen-1-yl-N-spiro[fluorene-9,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-xanthene]-3-amine
CID 161249951
N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)spiro[8-thia-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene-14,9'-fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)spiro[8-oxa-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene-14,9'-fluorene]-2'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)spiro[8-thia-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene-14,9'-fluorene]-2'-amine
CID 157148304
N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine
CID 158548002
N-(9,9-dimethylfluoren-2-yl)-8-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-1-yl]-N-(3-phenylphenyl)dibenzofuran-3-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-2-yl]-N-(4-phenylphenyl)dibenzofuran-2-amine
CID 163965802
N-[4-[8-[3-[4'-(4-dibenzofuran-2-yl-N-[2-(4-phenylphenyl)phenyl]anilino)spiro[acridine-9,9'-fluorene]-10-yl]phenyl]dibenzothiophen-4-yl]phenyl]-10-phenyl-N-[2-(4-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-4'-amine
CID 155296977

Frequently Asked Questions

What is the IUPAC name of N,10-diphenyl-N-[6-[9-(N-phenylanilino)dibenzothiophen-2-yl]dibenzothiophen-2-yl]spiro[acridine-9,9'-fluorene]-3-amine;N-phenyl-N-[4-[9-(N-phenylanilino)dibenzofuran-2-yl]phenyl]spiro[fluorene-9,9'-xanthene]-2-amine;N-phenyl-7-[4-(N-phenylanilino)phenyl]-N-spiro[fluorene-9,9'-thioxanthene]-2'-yldibenzofuran-3-amine?
The IUPAC name of N,10-diphenyl-N-[6-[9-(N-phenylanilino)dibenzothiophen-2-yl]dibenzothiophen-2-yl]spiro[acridine-9,9'-fluorene]-3-amine;N-phenyl-N-[4-[9-(N-phenylanilino)dibenzofuran-2-yl]phenyl]spiro[fluorene-9,9'-xanthene]-2-amine;N-phenyl-7-[4-(N-phenylanilino)phenyl]-N-spiro[fluorene-9,9'-thioxanthene]-2'-yldibenzofuran-3-amine (CID 159384046) is N,10-diphenyl-N-[6-[9-(N-phenylanilino)dibenzothiophen-2-yl]dibenzothiophen-2-yl]spiro[acridine-9,9'-fluorene]-3-amine;N-phenyl-N-[4-[9-(N-phenylanilino)dibenzofuran-2-yl]phenyl]spiro[fluorene-9,9'-xanthene]-2-amine;N-phenyl-7-[4-(N-phenylanilino)phenyl]-N-spiro[fluorene-9,9'-thioxanthene]-2'-yldibenzofuran-3-amine.
What is the SMILES notation for N,10-diphenyl-N-[6-[9-(N-phenylanilino)dibenzothiophen-2-yl]dibenzothiophen-2-yl]spiro[acridine-9,9'-fluorene]-3-amine;N-phenyl-N-[4-[9-(N-phenylanilino)dibenzofuran-2-yl]phenyl]spiro[fluorene-9,9'-xanthene]-2-amine;N-phenyl-7-[4-(N-phenylanilino)phenyl]-N-spiro[fluorene-9,9'-thioxanthene]-2'-yldibenzofuran-3-amine?
The canonical SMILES for N,10-diphenyl-N-[6-[9-(N-phenylanilino)dibenzothiophen-2-yl]dibenzothiophen-2-yl]spiro[acridine-9,9'-fluorene]-3-amine;N-phenyl-N-[4-[9-(N-phenylanilino)dibenzofuran-2-yl]phenyl]spiro[fluorene-9,9'-xanthene]-2-amine;N-phenyl-7-[4-(N-phenylanilino)phenyl]-N-spiro[fluorene-9,9'-thioxanthene]-2'-yldibenzofuran-3-amine is c1ccc(N(c2ccc(-c3ccc4oc5cccc(N(c6ccccc6)c6ccccc6)c5c4c3)cc2)c2ccc3c(c2)C2(c4ccccc4Oc4ccccc42)c2ccccc2-3)cc1.c1ccc(N(c2ccc3c(c2)N(c2ccccc2)c2ccccc2C32c3ccccc3-c3ccccc32)c2ccc3sc4c(-c5ccc6sc7cccc(N(c8ccccc8)c8ccccc8)c7c6c5)cccc4c3c2)cc1.c1ccc(N(c2ccccc2)c2ccc(-c3ccc4c(c3)oc3cc(N(c5ccccc5)c5ccc6c(c5)C5(c7ccccc7S6)c6ccccc6-c6ccccc65)ccc34)cc2)cc1.
What is the InChIKey of N,10-diphenyl-N-[6-[9-(N-phenylanilino)dibenzothiophen-2-yl]dibenzothiophen-2-yl]spiro[acridine-9,9'-fluorene]-3-amine;N-phenyl-N-[4-[9-(N-phenylanilino)dibenzofuran-2-yl]phenyl]spiro[fluorene-9,9'-xanthene]-2-amine;N-phenyl-7-[4-(N-phenylanilino)phenyl]-N-spiro[fluorene-9,9'-thioxanthene]-2'-yldibenzofuran-3-amine?
The InChIKey is LLGSXKAGXOVUTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C73H47N3S2.C61H40N2O2.C61H40N2OS/c1-5-21-49(22-6-1)74(54-40-42-64-67(47-54)76(52-27-11-4-12-28-52)65-36-18-17-35-63(65)73(64)61-33-15-13-29-56(61)57-30-14-16-34-62(57)73)53-41-44-68-59(46-53)58-32-19-31-55(72(58)78-68)48-39-43-69-60(45-48)71-66(37-20-38-70(71)77-69)75(50-23-7-2-8-24-50)51-25-9-3-10-26-51;1-4-17-43(18-5-1)62(47-36-37-49-48-23-10-11-24-51(48)61(54(49)40-47)52-25-12-14-28-57(52)65-58-29-15-13-26-53(58)61)46-34-31-41(32-35-46)42-33-38-56-50(39-42)60-55(27-16-30-59(60)64-56)63(44-19-6-2-7-20-44)45-21-8-3-9-22-45;1-4-16-43(17-5-1)62(44-18-6-2-7-19-44)46-31-28-41(29-32-46)42-30-35-51-52-36-33-48(40-58(52)64-57(51)38-42)63(45-20-8-3-9-21-45)47-34-37-60-56(39-47)61(55-26-14-15-27-59(55)65-60)53-24-12-10-22-49(53)50-23-11-13-25-54(50)61/h1-47H;2*1-40H.
What are the key properties of N,10-diphenyl-N-[6-[9-(N-phenylanilino)dibenzothiophen-2-yl]dibenzothiophen-2-yl]spiro[acridine-9,9'-fluorene]-3-amine;N-phenyl-N-[4-[9-(N-phenylanilino)dibenzofuran-2-yl]phenyl]spiro[fluorene-9,9'-xanthene]-2-amine;N-phenyl-7-[4-(N-phenylanilino)phenyl]-N-spiro[fluorene-9,9'-thioxanthene]-2'-yldibenzofuran-3-amine?
N,10-diphenyl-N-[6-[9-(N-phenylanilino)dibenzothiophen-2-yl]dibenzothiophen-2-yl]spiro[acridine-9,9'-fluorene]-3-amine;N-phenyl-N-[4-[9-(N-phenylanilino)dibenzofuran-2-yl]phenyl]spiro[fluorene-9,9'-xanthene]-2-amine;N-phenyl-7-[4-(N-phenylanilino)phenyl]-N-spiro[fluorene-9,9'-thioxanthene]-2'-yldibenzofuran-3-amine has a molecular weight of 2712.41 g/mol, XLogP of 54.86, 22 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for N,10-diphenyl-N-[6-[9-(N-phenylanilino)dibenzothiophen-2-yl]dibenzothiophen-2-yl]spiro[acridine-9,9'-fluorene]-3-amine;N-phenyl-N-[4-[9-(N-phenylanilino)dibenzofuran-2-yl]phenyl]spiro[fluorene-9,9'-xanthene]-2-amine;N-phenyl-7-[4-(N-phenylanilino)phenyl]-N-spiro[fluorene-9,9'-thioxanthene]-2'-yldibenzofuran-3-amine is sourced from PubChem (CID 159384046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).