9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;4-dibenzofuran-4-yl-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-(diisocyanomethylidene)-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene]propanedinitrile;9-(4-isocyanophenyl)-10-[4-[10-(4-methoxyphenyl)anthracen-9-yl]phenyl]anthracene;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline

C210H132F4N10O4 — CID 160541264

IUPAC9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;4-dibenzofuran-4-yl-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-(diisocyanomethylidene)-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene]propanedinitrile;9-(4-isocyanophenyl)-10-[4-[10-(4-methoxyphenyl)anthracen-9-yl]phenyl]anthracene;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline
SMILES[C-]#[N+]C([N+]#[C-])=c1c(F)c(F)c(=C(C#N)C#N)c(F)c1F.[C-]#[N+]c1ccc(-c2c3ccccc3c(-c3ccc(-c4c5ccccc5c(-c5ccc(OC)cc5)c5ccccc45)cc3)c3ccccc23)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(N(c5ccc(-c6ccccc6)cc5)c5ccc(-c6ccccc6)cc5)cc4)cc3)cc2)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1.c1ccc2c(c1)oc1c(-c3ccc(N(c4ccc(-c5cccc6c5oc5ccccc56)cc4)c4ccc(-c5cccc6c5oc5ccccc56)cc4)cc3)cccc12
InChIInChI=1S/C60H44N2.C54H33NO3.C48H31NO.C36H24N2.C12F4N4/c1-5-13-45(14-6-1)49-21-33-55(34-22-49)61(56-35-23-50(24-36-56)46-15-7-2-8-16-46)59-41-29-53(30-42-59)54-31-43-60(44-32-54)62(57-37-25-51(26-38-57)47-17-9-3-10-18-47)58-39-27-52(28-40-58)48-19-11-4-12-20-48;1-4-19-49-43(10-1)46-16-7-13-40(52(46)56-49)34-22-28-37(29-23-34)55(38-30-24-35(25-31-38)41-14-8-17-47-44-11-2-5-20-50(44)57-53(41)47)39-32-26-36(27-33-39)42-15-9-18-48-45-12-3-6-21-51(45)58-54(42)48;1-49-35-27-23-33(24-28-35)47-41-15-7-3-11-37(41)45(38-12-4-8-16-42(38)47)31-19-21-32(22-20-31)46-39-13-5-9-17-43(39)48(44-18-10-6-14-40(44)46)34-25-29-36(50-2)30-26-34;1-5-13-33-29(9-1)30-10-2-6-14-34(30)37(33)27-21-17-25(18-22-27)26-19-23-28(24-20-26)38-35-15-7-3-11-31(35)32-12-4-8-16-36(32)38;1-19-12(20-2)7-10(15)8(13)6(5(3-17)4-18)9(14)11(7)16/h1-44H;1-33H;3-30H,2H3;1-24H;
InChIKeyQWUWZDKWERTLKZ-UHFFFAOYSA-N
MW2935.42 g/mol
LogP57.24
Rot. Bonds25

About 9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;4-dibenzofuran-4-yl-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-(diisocyanomethylidene)-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene]propanedinitrile;9-(4-isocyanophenyl)-10-[4-[10-(4-methoxyphenyl)anthracen-9-yl]phenyl]anthracene;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline

9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;4-dibenzofuran-4-yl-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-(diisocyanomethylidene)-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene]propanedinitrile;9-(4-isocyanophenyl)-10-[4-[10-(4-methoxyphenyl)anthracen-9-yl]phenyl]anthracene;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline (PubChem CID 160541264) has the molecular formula C210H132F4N10O4 and a molecular weight of 2935.42 g/mol. Its IUPAC name is 9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;4-dibenzofuran-4-yl-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-(diisocyanomethylidene)-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene]propanedinitrile;9-(4-isocyanophenyl)-10-[4-[10-(4-methoxyphenyl)anthracen-9-yl]phenyl]anthracene;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline.

Molecular Properties

Compound Name9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;4-dibenzofuran-4-yl-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-(diisocyanomethylidene)-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene]propanedinitrile;9-(4-isocyanophenyl)-10-[4-[10-(4-methoxyphenyl)anthracen-9-yl]phenyl]anthracene;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline
PubChem CID160541264
Molecular FormulaC210H132F4N10O4
Molecular Weight2935.42 g/mol
Exact Mass2933.04
IUPAC Name9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;4-dibenzofuran-4-yl-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-(diisocyanomethylidene)-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene]propanedinitrile;9-(4-isocyanophenyl)-10-[4-[10-(4-methoxyphenyl)anthracen-9-yl]phenyl]anthracene;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline
SMILES[C-]#[N+]C([N+]#[C-])=c1c(F)c(F)c(=C(C#N)C#N)c(F)c1F.[C-]#[N+]c1ccc(-c2c3ccccc3c(-c3ccc(-c4c5ccccc5c(-c5ccc(OC)cc5)c5ccccc45)cc3)c3ccccc23)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(N(c5ccc(-c6ccccc6)cc5)c5ccc(-c6ccccc6)cc5)cc4)cc3)cc2)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1.c1ccc2c(c1)oc1c(-c3ccc(N(c4ccc(-c5cccc6c5oc5ccccc56)cc4)c4ccc(-c5cccc6c5oc5ccccc56)cc4)cc3)cccc12
InChIInChI=1S/C60H44N2.C54H33NO3.C48H31NO.C36H24N2.C12F4N4/c1-5-13-45(14-6-1)49-21-33-55(34-22-49)61(56-35-23-50(24-36-56)46-15-7-2-8-16-46)59-41-29-53(30-42-59)54-31-43-60(44-32-54)62(57-37-25-51(26-38-57)47-17-9-3-10-18-47)58-39-27-52(28-40-58)48-19-11-4-12-20-48;1-4-19-49-43(10-1)46-16-7-13-40(52(46)56-49)34-22-28-37(29-23-34)55(38-30-24-35(25-31-38)41-14-8-17-47-44-11-2-5-20-50(44)57-53(41)47)39-32-26-36(27-33-39)42-15-9-18-48-45-12-3-6-21-51(45)58-54(42)48;1-49-35-27-23-33(24-28-35)47-41-15-7-3-11-37(41)45(38-12-4-8-16-42(38)47)31-19-21-32(22-20-31)46-39-13-5-9-17-43(39)48(44-18-10-6-14-40(44)46)34-25-29-36(50-2)30-26-34;1-5-13-33-29(9-1)30-10-2-6-14-34(30)37(33)27-21-17-25(18-22-27)26-19-23-28(24-20-26)38-35-15-7-3-11-31(35)32-12-4-8-16-36(32)38;1-19-12(20-2)7-10(15)8(13)6(5(3-17)4-18)9(14)11(7)16/h1-44H;1-33H;3-30H,2H3;1-24H;
InChIKeyQWUWZDKWERTLKZ-UHFFFAOYSA-N
XLogP57.24
TPSA128.89 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds25
Heavy Atoms228
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002935.42
LogP ≤ 557.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;4-dibenzofuran-4-yl-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-(diisocyanomethylidene)-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene]propanedinitrile;9-(4-isocyanophenyl)-10-[4-[10-(4-methoxyphenyl)anthracen-9-yl]phenyl]anthracene;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline with MolForge

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Related Compounds

4-[4-(N-(4-carbazol-9-ylphenyl)-4-dibenzofuran-4-ylanilino)phenyl]-N,N-diphenylaniline
CID 58510633
N-[4-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 90207163
N,N-bis(4-carbazol-9-ylphenyl)-4-dibenzofuran-4-ylaniline
CID 58510642
N-[3-[3-[3-dibenzofuran-4-yl-5-[9-(4-isocyanophenyl)carbazol-2-yl]phenyl]phenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 140728916
N,N-bis(4-dibenzofuran-4-ylphenyl)-4-(4-phenylphenyl)aniline;9-[3-carbazol-9-yl-5-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]carbazole;(2Z)-2-[(10E)-10-[cyano(isocyano)methylidene]-2-methoxy-8-(trifluoromethoxy)indeno[2,1-b]fluoren-12-ylidene]-2-isocyanoacetonitrile;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(N-[4-(4-phenylphenyl)phenyl]anilino)phenyl]phenyl]aniline
CID 158418453
N-(4-dibenzofuran-4-ylphenyl)-9-phenyl-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine
CID 58510827
4-(3-carbazol-9-ylphenyl)-N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(4-dibenzofuran-4-ylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-(3-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]aniline;N-[4-(3-carbazol-9-ylphenyl)phenyl]-4-(3-dibenzofuran-4-ylphenyl)-N-[4-(3-phenylphenyl)phenyl]aniline
CID 159453315
4-[9-(4-dibenzofuran-4-ylphenyl)-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]-N,N-diphenylaniline
CID 164786369
N-[4-[9-(3-dibenzofuran-4-ylphenyl)carbazol-3-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-[9-(4-dibenzofuran-2-ylphenyl)carbazol-3-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 160835458
N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-4-phenylaniline
CID 139545258
N-(4-dibenzofuran-4-ylphenyl)-5-phenyl-N-(4-phenylphenyl)benzo[b]carbazol-3-amine
CID 139571792
N-[4-(4-benzo[c]carbazol-7-ylphenyl)phenyl]-N-(4-dibenzofuran-4-ylphenyl)-4-phenylaniline
CID 170926661

Frequently Asked Questions

What is the IUPAC name of 9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;4-dibenzofuran-4-yl-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-(diisocyanomethylidene)-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene]propanedinitrile;9-(4-isocyanophenyl)-10-[4-[10-(4-methoxyphenyl)anthracen-9-yl]phenyl]anthracene;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline?
The IUPAC name of 9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;4-dibenzofuran-4-yl-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-(diisocyanomethylidene)-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene]propanedinitrile;9-(4-isocyanophenyl)-10-[4-[10-(4-methoxyphenyl)anthracen-9-yl]phenyl]anthracene;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline (CID 160541264) is 9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;4-dibenzofuran-4-yl-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-(diisocyanomethylidene)-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene]propanedinitrile;9-(4-isocyanophenyl)-10-[4-[10-(4-methoxyphenyl)anthracen-9-yl]phenyl]anthracene;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline.
What is the SMILES notation for 9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;4-dibenzofuran-4-yl-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-(diisocyanomethylidene)-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene]propanedinitrile;9-(4-isocyanophenyl)-10-[4-[10-(4-methoxyphenyl)anthracen-9-yl]phenyl]anthracene;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline?
The canonical SMILES for 9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;4-dibenzofuran-4-yl-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-(diisocyanomethylidene)-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene]propanedinitrile;9-(4-isocyanophenyl)-10-[4-[10-(4-methoxyphenyl)anthracen-9-yl]phenyl]anthracene;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline is [C-]#[N+]C([N+]#[C-])=c1c(F)c(F)c(=C(C#N)C#N)c(F)c1F.[C-]#[N+]c1ccc(-c2c3ccccc3c(-c3ccc(-c4c5ccccc5c(-c5ccc(OC)cc5)c5ccccc45)cc3)c3ccccc23)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(N(c5ccc(-c6ccccc6)cc5)c5ccc(-c6ccccc6)cc5)cc4)cc3)cc2)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1.c1ccc2c(c1)oc1c(-c3ccc(N(c4ccc(-c5cccc6c5oc5ccccc56)cc4)c4ccc(-c5cccc6c5oc5ccccc56)cc4)cc3)cccc12.
What is the InChIKey of 9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;4-dibenzofuran-4-yl-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-(diisocyanomethylidene)-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene]propanedinitrile;9-(4-isocyanophenyl)-10-[4-[10-(4-methoxyphenyl)anthracen-9-yl]phenyl]anthracene;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline?
The InChIKey is QWUWZDKWERTLKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H44N2.C54H33NO3.C48H31NO.C36H24N2.C12F4N4/c1-5-13-45(14-6-1)49-21-33-55(34-22-49)61(56-35-23-50(24-36-56)46-15-7-2-8-16-46)59-41-29-53(30-42-59)54-31-43-60(44-32-54)62(57-37-25-51(26-38-57)47-17-9-3-10-18-47)58-39-27-52(28-40-58)48-19-11-4-12-20-48;1-4-19-49-43(10-1)46-16-7-13-40(52(46)56-49)34-22-28-37(29-23-34)55(38-30-24-35(25-31-38)41-14-8-17-47-44-11-2-5-20-50(44)57-53(41)47)39-32-26-36(27-33-39)42-15-9-18-48-45-12-3-6-21-51(45)58-54(42)48;1-49-35-27-23-33(24-28-35)47-41-15-7-3-11-37(41)45(38-12-4-8-16-42(38)47)31-19-21-32(22-20-31)46-39-13-5-9-17-43(39)48(44-18-10-6-14-40(44)46)34-25-29-36(50-2)30-26-34;1-5-13-33-29(9-1)30-10-2-6-14-34(30)37(33)27-21-17-25(18-22-27)26-19-23-28(24-20-26)38-35-15-7-3-11-31(35)32-12-4-8-16-36(32)38;1-19-12(20-2)7-10(15)8(13)6(5(3-17)4-18)9(14)11(7)16/h1-44H;1-33H;3-30H,2H3;1-24H;.
What are the key properties of 9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;4-dibenzofuran-4-yl-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-(diisocyanomethylidene)-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene]propanedinitrile;9-(4-isocyanophenyl)-10-[4-[10-(4-methoxyphenyl)anthracen-9-yl]phenyl]anthracene;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline?
9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;4-dibenzofuran-4-yl-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-(diisocyanomethylidene)-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene]propanedinitrile;9-(4-isocyanophenyl)-10-[4-[10-(4-methoxyphenyl)anthracen-9-yl]phenyl]anthracene;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline has a molecular weight of 2935.42 g/mol, XLogP of 57.24, 25 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;4-dibenzofuran-4-yl-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-(diisocyanomethylidene)-2,3,5,6-tetrafluorocyclohexa-2,5-dien-1-ylidene]propanedinitrile;9-(4-isocyanophenyl)-10-[4-[10-(4-methoxyphenyl)anthracen-9-yl]phenyl]anthracene;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline is sourced from PubChem (CID 160541264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).