8-(9,9-diphenylfluoren-3-yl)-2-N,2-N,4-N,4-N-tetraphenyldibenzothiophene-2,4-diamine;3-(N-[8-(9-methyl-9-phenylfluoren-3-yl)-4-(N-(9-phenylcarbazol-3-yl)anilino)dibenzofuran-2-yl]anilino)benzonitrile;2-N,4-N,8-tris(9,9-dimethylfluoren-3-yl)-2-N,4-N-diphenyldibenzofuran-2,4-diamine

C199H142N8O2S — CID 160897173

IUPAC8-(9,9-diphenylfluoren-3-yl)-2-N,2-N,4-N,4-N-tetraphenyldibenzothiophene-2,4-diamine;3-(N-[8-(9-methyl-9-phenylfluoren-3-yl)-4-(N-(9-phenylcarbazol-3-yl)anilino)dibenzofuran-2-yl]anilino)benzonitrile;2-N,4-N,8-tris(9,9-dimethylfluoren-3-yl)-2-N,4-N-diphenyldibenzofuran-2,4-diamine
SMILESCC1(C)c2ccccc2-c2cc(-c3ccc4oc5c(N(c6ccccc6)c6ccc7c(c6)-c6ccccc6C7(C)C)cc(N(c6ccccc6)c6ccc7c(c6)-c6ccccc6C7(C)C)cc5c4c3)ccc21.CC1(c2ccccc2)c2ccccc2-c2cc(-c3ccc4oc5c(N(c6ccccc6)c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc(N(c6ccccc6)c6cccc(C#N)c6)cc5c4c3)ccc21.c1ccc(N(c2ccccc2)c2cc(N(c3ccccc3)c3ccccc3)c3sc4ccc(-c5ccc6c(c5)-c5ccccc5C6(c5ccccc5)c5ccccc5)cc4c3c2)cc1
InChIInChI=1S/C69H46N4O.C69H54N2O.C61H42N2S/c1-69(49-20-6-2-7-21-49)62-31-16-14-29-56(62)58-40-47(33-36-63(58)69)48-34-38-67-60(41-48)61-43-55(71(50-22-8-3-9-23-50)53-28-18-19-46(39-53)45-70)44-66(68(61)74-67)72(51-24-10-4-11-25-51)54-35-37-65-59(42-54)57-30-15-17-32-64(57)73(65)52-26-12-5-13-27-52;1-67(2)58-26-16-13-23-50(58)53-37-43(29-33-61(53)67)44-30-36-65-56(38-44)57-41-49(70(45-19-9-7-10-20-45)47-31-34-62-54(39-47)51-24-14-17-27-59(51)68(62,3)4)42-64(66(57)72-65)71(46-21-11-8-12-22-46)48-32-35-63-55(40-48)52-25-15-18-28-60(52)69(63,5)6;1-7-21-45(22-8-1)61(46-23-9-2-10-24-46)56-34-20-19-33-52(56)53-39-43(35-37-57(53)61)44-36-38-59-54(40-44)55-41-51(62(47-25-11-3-12-26-47)48-27-13-4-14-28-48)42-58(60(55)64-59)63(49-29-15-5-16-30-49)50-31-17-6-18-32-50/h2-44H,1H3;7-42H,1-6H3;1-42H
InChIKeySPAJQHNYJJUKGA-UHFFFAOYSA-N
MW2709.45 g/mol
LogP54.63
Rot. Bonds25

About 8-(9,9-diphenylfluoren-3-yl)-2-N,2-N,4-N,4-N-tetraphenyldibenzothiophene-2,4-diamine;3-(N-[8-(9-methyl-9-phenylfluoren-3-yl)-4-(N-(9-phenylcarbazol-3-yl)anilino)dibenzofuran-2-yl]anilino)benzonitrile;2-N,4-N,8-tris(9,9-dimethylfluoren-3-yl)-2-N,4-N-diphenyldibenzofuran-2,4-diamine

8-(9,9-diphenylfluoren-3-yl)-2-N,2-N,4-N,4-N-tetraphenyldibenzothiophene-2,4-diamine;3-(N-[8-(9-methyl-9-phenylfluoren-3-yl)-4-(N-(9-phenylcarbazol-3-yl)anilino)dibenzofuran-2-yl]anilino)benzonitrile;2-N,4-N,8-tris(9,9-dimethylfluoren-3-yl)-2-N,4-N-diphenyldibenzofuran-2,4-diamine (PubChem CID 160897173) has the molecular formula C199H142N8O2S and a molecular weight of 2709.45 g/mol. Its IUPAC name is 8-(9,9-diphenylfluoren-3-yl)-2-N,2-N,4-N,4-N-tetraphenyldibenzothiophene-2,4-diamine;3-(N-[8-(9-methyl-9-phenylfluoren-3-yl)-4-(N-(9-phenylcarbazol-3-yl)anilino)dibenzofuran-2-yl]anilino)benzonitrile;2-N,4-N,8-tris(9,9-dimethylfluoren-3-yl)-2-N,4-N-diphenyldibenzofuran-2,4-diamine.

Molecular Properties

Compound Name8-(9,9-diphenylfluoren-3-yl)-2-N,2-N,4-N,4-N-tetraphenyldibenzothiophene-2,4-diamine;3-(N-[8-(9-methyl-9-phenylfluoren-3-yl)-4-(N-(9-phenylcarbazol-3-yl)anilino)dibenzofuran-2-yl]anilino)benzonitrile;2-N,4-N,8-tris(9,9-dimethylfluoren-3-yl)-2-N,4-N-diphenyldibenzofuran-2,4-diamine
PubChem CID160897173
Molecular FormulaC199H142N8O2S
Molecular Weight2709.45 g/mol
Exact Mass2707.10
IUPAC Name8-(9,9-diphenylfluoren-3-yl)-2-N,2-N,4-N,4-N-tetraphenyldibenzothiophene-2,4-diamine;3-(N-[8-(9-methyl-9-phenylfluoren-3-yl)-4-(N-(9-phenylcarbazol-3-yl)anilino)dibenzofuran-2-yl]anilino)benzonitrile;2-N,4-N,8-tris(9,9-dimethylfluoren-3-yl)-2-N,4-N-diphenyldibenzofuran-2,4-diamine
SMILESCC1(C)c2ccccc2-c2cc(-c3ccc4oc5c(N(c6ccccc6)c6ccc7c(c6)-c6ccccc6C7(C)C)cc(N(c6ccccc6)c6ccc7c(c6)-c6ccccc6C7(C)C)cc5c4c3)ccc21.CC1(c2ccccc2)c2ccccc2-c2cc(-c3ccc4oc5c(N(c6ccccc6)c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc(N(c6ccccc6)c6cccc(C#N)c6)cc5c4c3)ccc21.c1ccc(N(c2ccccc2)c2cc(N(c3ccccc3)c3ccccc3)c3sc4ccc(-c5ccc6c(c5)-c5ccccc5C6(c5ccccc5)c5ccccc5)cc4c3c2)cc1
InChIInChI=1S/C69H46N4O.C69H54N2O.C61H42N2S/c1-69(49-20-6-2-7-21-49)62-31-16-14-29-56(62)58-40-47(33-36-63(58)69)48-34-38-67-60(41-48)61-43-55(71(50-22-8-3-9-23-50)53-28-18-19-46(39-53)45-70)44-66(68(61)74-67)72(51-24-10-4-11-25-51)54-35-37-65-59(42-54)57-30-15-17-32-64(57)73(65)52-26-12-5-13-27-52;1-67(2)58-26-16-13-23-50(58)53-37-43(29-33-61(53)67)44-30-36-65-56(38-44)57-41-49(70(45-19-9-7-10-20-45)47-31-34-62-54(39-47)51-24-14-17-27-59(51)68(62,3)4)42-64(66(57)72-65)71(46-21-11-8-12-22-46)48-32-35-63-55(40-48)52-25-15-18-28-60(52)69(63,5)6;1-7-21-45(22-8-1)61(46-23-9-2-10-24-46)56-34-20-19-33-52(56)53-39-43(35-37-57(53)61)44-36-38-59-54(40-44)55-41-51(62(47-25-11-3-12-26-47)48-27-13-4-14-28-48)42-58(60(55)64-59)63(49-29-15-5-16-30-49)50-31-17-6-18-32-50/h2-44H,1H3;7-42H,1-6H3;1-42H
InChIKeySPAJQHNYJJUKGA-UHFFFAOYSA-N
XLogP54.63
TPSA74.44 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds25
Heavy Atoms210
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002709.45
LogP ≤ 554.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 8-(9,9-diphenylfluoren-3-yl)-2-N,2-N,4-N,4-N-tetraphenyldibenzothiophene-2,4-diamine;3-(N-[8-(9-methyl-9-phenylfluoren-3-yl)-4-(N-(9-phenylcarbazol-3-yl)anilino)dibenzofuran-2-yl]anilino)benzonitrile;2-N,4-N,8-tris(9,9-dimethylfluoren-3-yl)-2-N,4-N-diphenyldibenzofuran-2,4-diamine with MolForge

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Related Compounds

8-(9-dibenzothiophen-4-ylcarbazol-3-yl)-2-N,2-N,4-N,4-N-tetraphenyldibenzofuran-2,4-diamine;4-N-dibenzothiophen-2-yl-4-N-dibenzothiophen-3-yl-8-(9,9-dimethylfluoren-3-yl)-2-N-phenyl-2-N-(4-phenylphenyl)dibenzothiophene-2,4-diamine;8-(9,9-dimethylfluoren-3-yl)-2-N,2-N,4-N,4-N-tetraphenyldibenzothiophene-2,4-diamine;2-N,4-N-diphenyl-2-N,4-N-bis(4-phenylphenyl)-8-(9-pyridin-3-ylcarbazol-3-yl)dibenzofuran-2,4-diamine;3-(N-[8-(9-methyl-9-phenylfluoren-3-yl)-4-(N-(9-phenylcarbazol-3-yl)anilino)dibenzofuran-2-yl]anilino)benzonitrile;2-N,4-N,8-tris(9,9-dimethylfluoren-3-yl)-2-N,4-N-diphenyldibenzofuran-2,4-diamine
CID 158339656
N-(9,9-dimethylfluoren-3-yl)-N-[4-[9-phenyl-6-(9-phenylfluoren-9-yl)carbazol-3-yl]phenyl]dibenzofuran-2-amine
CID 167214769
N-dibenzothiophen-3-yl-N-(9,9-diphenylfluoren-2-yl)-2-(9-phenylcarbazol-3-yl)dibenzofuran-4-amine
CID 122462823
N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-4-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzothiophen-4-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]triphenylen-2-amine
CID 160893583
3-carbazol-9-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N-(4-carbazol-9-ylphenyl)-4-dibenzofuran-2-yl-N-[4-(9-phenylfluoren-9-yl)phenyl]naphthalen-1-amine;N-(4-carbazol-9-ylphenyl)-3-dibenzothiophen-2-yl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline
CID 158939425
9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)spiro[anthracene-10,9'-fluorene]-3'-amine;9,9-diphenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)spiro[anthracene-10,9'-fluorene]-3'-amine
CID 157239139
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(9,9-diphenylfluoren-2-yl)naphtho[2,1-b][1]benzofuran-6-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(4-phenylphenyl)phenyl]naphtho[2,1-b][1]benzofuran-6-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(9,9'-spirobi[fluorene]-2-yl)naphtho[2,1-b][1]benzofuran-6-amine;N-(9,9-dimethylfluoren-3-yl)-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]naphtho[2,1-b][1]benzofuran-6-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]naphtho[2,1-b][1]benzofuran-6-amine;N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-N-(9,9'-spirobi[fluorene]-2-yl)naphtho[2,1-b][1]benzofuran-6-amine
CID 157461382
N-(9,9-diphenylfluoren-3-yl)-N-[3-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]dibenzofuran-3-amine
CID 129256023
N,N-bis(4-dibenzothiophen-4-ylphenyl)-9,9-diphenylfluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-9,9-diphenylfluoren-2-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-2-ylphenyl)-9,9-diphenylfluoren-2-amine
CID 158676127
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(4-dibenzothiophen-2-ylphenyl)-9,9-diphenylfluoren-3-amine
CID 121424718
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(4-dibenzofuran-2-ylphenyl)-9,9-diphenylfluoren-3-amine
CID 121424697
8-(9-dibenzothiophen-4-ylcarbazol-1-yl)-2-N,2-N,4-N,4-N-tetraphenyldibenzofuran-2,4-diamine;4-N-dibenzothiophen-2-yl-4-N-dibenzothiophen-3-yl-8-(9,9-dimethylfluoren-1-yl)-2-N-phenyl-2-N-(4-phenylphenyl)dibenzothiophene-2,4-diamine;8-(9,9-dimethylfluoren-1-yl)-2-N,2-N,4-N,4-N-tetraphenyldibenzothiophene-2,4-diamine;2-N,4-N-diphenyl-2-N,4-N-bis(4-phenylphenyl)-8-(9-pyridin-3-ylcarbazol-1-yl)dibenzofuran-2,4-diamine
CID 158064287

Frequently Asked Questions

What is the IUPAC name of 8-(9,9-diphenylfluoren-3-yl)-2-N,2-N,4-N,4-N-tetraphenyldibenzothiophene-2,4-diamine;3-(N-[8-(9-methyl-9-phenylfluoren-3-yl)-4-(N-(9-phenylcarbazol-3-yl)anilino)dibenzofuran-2-yl]anilino)benzonitrile;2-N,4-N,8-tris(9,9-dimethylfluoren-3-yl)-2-N,4-N-diphenyldibenzofuran-2,4-diamine?
The IUPAC name of 8-(9,9-diphenylfluoren-3-yl)-2-N,2-N,4-N,4-N-tetraphenyldibenzothiophene-2,4-diamine;3-(N-[8-(9-methyl-9-phenylfluoren-3-yl)-4-(N-(9-phenylcarbazol-3-yl)anilino)dibenzofuran-2-yl]anilino)benzonitrile;2-N,4-N,8-tris(9,9-dimethylfluoren-3-yl)-2-N,4-N-diphenyldibenzofuran-2,4-diamine (CID 160897173) is 8-(9,9-diphenylfluoren-3-yl)-2-N,2-N,4-N,4-N-tetraphenyldibenzothiophene-2,4-diamine;3-(N-[8-(9-methyl-9-phenylfluoren-3-yl)-4-(N-(9-phenylcarbazol-3-yl)anilino)dibenzofuran-2-yl]anilino)benzonitrile;2-N,4-N,8-tris(9,9-dimethylfluoren-3-yl)-2-N,4-N-diphenyldibenzofuran-2,4-diamine.
What is the SMILES notation for 8-(9,9-diphenylfluoren-3-yl)-2-N,2-N,4-N,4-N-tetraphenyldibenzothiophene-2,4-diamine;3-(N-[8-(9-methyl-9-phenylfluoren-3-yl)-4-(N-(9-phenylcarbazol-3-yl)anilino)dibenzofuran-2-yl]anilino)benzonitrile;2-N,4-N,8-tris(9,9-dimethylfluoren-3-yl)-2-N,4-N-diphenyldibenzofuran-2,4-diamine?
The canonical SMILES for 8-(9,9-diphenylfluoren-3-yl)-2-N,2-N,4-N,4-N-tetraphenyldibenzothiophene-2,4-diamine;3-(N-[8-(9-methyl-9-phenylfluoren-3-yl)-4-(N-(9-phenylcarbazol-3-yl)anilino)dibenzofuran-2-yl]anilino)benzonitrile;2-N,4-N,8-tris(9,9-dimethylfluoren-3-yl)-2-N,4-N-diphenyldibenzofuran-2,4-diamine is CC1(C)c2ccccc2-c2cc(-c3ccc4oc5c(N(c6ccccc6)c6ccc7c(c6)-c6ccccc6C7(C)C)cc(N(c6ccccc6)c6ccc7c(c6)-c6ccccc6C7(C)C)cc5c4c3)ccc21.CC1(c2ccccc2)c2ccccc2-c2cc(-c3ccc4oc5c(N(c6ccccc6)c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc(N(c6ccccc6)c6cccc(C#N)c6)cc5c4c3)ccc21.c1ccc(N(c2ccccc2)c2cc(N(c3ccccc3)c3ccccc3)c3sc4ccc(-c5ccc6c(c5)-c5ccccc5C6(c5ccccc5)c5ccccc5)cc4c3c2)cc1.
What is the InChIKey of 8-(9,9-diphenylfluoren-3-yl)-2-N,2-N,4-N,4-N-tetraphenyldibenzothiophene-2,4-diamine;3-(N-[8-(9-methyl-9-phenylfluoren-3-yl)-4-(N-(9-phenylcarbazol-3-yl)anilino)dibenzofuran-2-yl]anilino)benzonitrile;2-N,4-N,8-tris(9,9-dimethylfluoren-3-yl)-2-N,4-N-diphenyldibenzofuran-2,4-diamine?
The InChIKey is SPAJQHNYJJUKGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C69H46N4O.C69H54N2O.C61H42N2S/c1-69(49-20-6-2-7-21-49)62-31-16-14-29-56(62)58-40-47(33-36-63(58)69)48-34-38-67-60(41-48)61-43-55(71(50-22-8-3-9-23-50)53-28-18-19-46(39-53)45-70)44-66(68(61)74-67)72(51-24-10-4-11-25-51)54-35-37-65-59(42-54)57-30-15-17-32-64(57)73(65)52-26-12-5-13-27-52;1-67(2)58-26-16-13-23-50(58)53-37-43(29-33-61(53)67)44-30-36-65-56(38-44)57-41-49(70(45-19-9-7-10-20-45)47-31-34-62-54(39-47)51-24-14-17-27-59(51)68(62,3)4)42-64(66(57)72-65)71(46-21-11-8-12-22-46)48-32-35-63-55(40-48)52-25-15-18-28-60(52)69(63,5)6;1-7-21-45(22-8-1)61(46-23-9-2-10-24-46)56-34-20-19-33-52(56)53-39-43(35-37-57(53)61)44-36-38-59-54(40-44)55-41-51(62(47-25-11-3-12-26-47)48-27-13-4-14-28-48)42-58(60(55)64-59)63(49-29-15-5-16-30-49)50-31-17-6-18-32-50/h2-44H,1H3;7-42H,1-6H3;1-42H.
What are the key properties of 8-(9,9-diphenylfluoren-3-yl)-2-N,2-N,4-N,4-N-tetraphenyldibenzothiophene-2,4-diamine;3-(N-[8-(9-methyl-9-phenylfluoren-3-yl)-4-(N-(9-phenylcarbazol-3-yl)anilino)dibenzofuran-2-yl]anilino)benzonitrile;2-N,4-N,8-tris(9,9-dimethylfluoren-3-yl)-2-N,4-N-diphenyldibenzofuran-2,4-diamine?
8-(9,9-diphenylfluoren-3-yl)-2-N,2-N,4-N,4-N-tetraphenyldibenzothiophene-2,4-diamine;3-(N-[8-(9-methyl-9-phenylfluoren-3-yl)-4-(N-(9-phenylcarbazol-3-yl)anilino)dibenzofuran-2-yl]anilino)benzonitrile;2-N,4-N,8-tris(9,9-dimethylfluoren-3-yl)-2-N,4-N-diphenyldibenzofuran-2,4-diamine has a molecular weight of 2709.45 g/mol, XLogP of 54.63, 25 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(9,9-diphenylfluoren-3-yl)-2-N,2-N,4-N,4-N-tetraphenyldibenzothiophene-2,4-diamine;3-(N-[8-(9-methyl-9-phenylfluoren-3-yl)-4-(N-(9-phenylcarbazol-3-yl)anilino)dibenzofuran-2-yl]anilino)benzonitrile;2-N,4-N,8-tris(9,9-dimethylfluoren-3-yl)-2-N,4-N-diphenyldibenzofuran-2,4-diamine is sourced from PubChem (CID 160897173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).