N-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-N-(4-naphtho[2,1-b][1]benzothiol-5-ylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-naphtho[2,3-b][1]benzothiol-2-yl-N-(4-phenylphenyl)dibenzofuran-2-amine

C145H93N3O2S2 — CID 161371541

IUPACN-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-N-(4-naphtho[2,1-b][1]benzothiol-5-ylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-naphtho[2,3-b][1]benzothiol-2-yl-N-(4-phenylphenyl)dibenzofuran-2-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc4oc5ccccc5c4c3)c3ccc4sc5cc6ccccc6cc5c4c3)cc2)cc1.c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2ccc(N(c3ccc(-c4cccc5ccccc45)cc3)c3ccc(-c4cc5sc6ccccc6c5c5ccccc45)cc3)cc21
InChIInChI=1S/C63H39NS.C42H29NO.C40H25NOS/c1-2-16-46-40(14-1)15-13-23-47(46)41-28-32-43(33-29-41)64(44-34-30-42(31-35-44)55-39-61-62(53-21-4-3-17-48(53)55)54-22-8-12-27-60(54)65-61)45-36-37-52-51-20-7-11-26-58(51)63(59(52)38-45)56-24-9-5-18-49(56)50-19-6-10-25-57(50)63;1-3-9-30(10-4-1)32-15-22-36(23-16-32)43(37-24-17-33(18-25-37)31-11-5-2-6-12-31)38-26-19-34(20-27-38)35-21-28-42-40(29-35)39-13-7-8-14-41(39)44-42;1-2-8-26(9-3-1)27-14-16-30(17-15-27)41(31-18-20-38-34(24-31)33-12-6-7-13-37(33)42-38)32-19-21-39-36(25-32)35-22-28-10-4-5-11-29(28)23-40(35)43-39/h1-39H;1-29H;1-25H
InChIKeyVQNGLPCAXPTXGB-UHFFFAOYSA-N
MW1973.49 g/mol
LogP41.81
Rot. Bonds15

About N-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-N-(4-naphtho[2,1-b][1]benzothiol-5-ylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-naphtho[2,3-b][1]benzothiol-2-yl-N-(4-phenylphenyl)dibenzofuran-2-amine

N-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-N-(4-naphtho[2,1-b][1]benzothiol-5-ylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-naphtho[2,3-b][1]benzothiol-2-yl-N-(4-phenylphenyl)dibenzofuran-2-amine (PubChem CID 161371541) has the molecular formula C145H93N3O2S2 and a molecular weight of 1973.49 g/mol. Its IUPAC name is N-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-N-(4-naphtho[2,1-b][1]benzothiol-5-ylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-naphtho[2,3-b][1]benzothiol-2-yl-N-(4-phenylphenyl)dibenzofuran-2-amine.

Molecular Properties

Compound NameN-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-N-(4-naphtho[2,1-b][1]benzothiol-5-ylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-naphtho[2,3-b][1]benzothiol-2-yl-N-(4-phenylphenyl)dibenzofuran-2-amine
PubChem CID161371541
Molecular FormulaC145H93N3O2S2
Molecular Weight1973.49 g/mol
Exact Mass1971.67
IUPAC NameN-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-N-(4-naphtho[2,1-b][1]benzothiol-5-ylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-naphtho[2,3-b][1]benzothiol-2-yl-N-(4-phenylphenyl)dibenzofuran-2-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc4oc5ccccc5c4c3)c3ccc4sc5cc6ccccc6cc5c4c3)cc2)cc1.c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2ccc(N(c3ccc(-c4cccc5ccccc45)cc3)c3ccc(-c4cc5sc6ccccc6c5c5ccccc45)cc3)cc21
InChIInChI=1S/C63H39NS.C42H29NO.C40H25NOS/c1-2-16-46-40(14-1)15-13-23-47(46)41-28-32-43(33-29-41)64(44-34-30-42(31-35-44)55-39-61-62(53-21-4-3-17-48(53)55)54-22-8-12-27-60(54)65-61)45-36-37-52-51-20-7-11-26-58(51)63(59(52)38-45)56-24-9-5-18-49(56)50-19-6-10-25-57(50)63;1-3-9-30(10-4-1)32-15-22-36(23-16-32)43(37-24-17-33(18-25-37)31-11-5-2-6-12-31)38-26-19-34(20-27-38)35-21-28-42-40(29-35)39-13-7-8-14-41(39)44-42;1-2-8-26(9-3-1)27-14-16-30(17-15-27)41(31-18-20-38-34(24-31)33-12-6-7-13-37(33)42-38)32-19-21-39-36(25-32)35-22-28-10-4-5-11-29(28)23-40(35)43-39/h1-39H;1-29H;1-25H
InChIKeyVQNGLPCAXPTXGB-UHFFFAOYSA-N
XLogP41.81
TPSA36.00 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds15
Heavy Atoms152
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001973.49
LogP ≤ 541.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze N-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-N-(4-naphtho[2,1-b][1]benzothiol-5-ylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-naphtho[2,3-b][1]benzothiol-2-yl-N-(4-phenylphenyl)dibenzofuran-2-amine with MolForge

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Related Compounds

N-(4-dibenzofuran-2-ylphenyl)-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-(4-naphtho[1,2-b][1]benzothiol-5-ylphenyl)-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-(4-naphtho[2,1-b][1]benzothiol-5-ylphenyl)-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 157223222
N-(4-dibenzofuran-2-ylphenyl)-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-(4-dibenzothiophen-4-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 158172410
N,N-bis(4-dibenzofuran-2-ylphenyl)dibenzofuran-2-amine;N,N-bis(4-naphtho[2,1-b][1]benzofuran-10-ylphenyl)dibenzofuran-2-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-methylphenyl)-9,9-diphenylfluoren-2-amine;N-dibenzothiophen-2-yl-N-(4-phenylphenyl)naphtho[2,3-b][1]benzofuran-2-amine
CID 167549806
4-N-dibenzofuran-2-yl-2-N'-dibenzothiophen-2-yl-2-N',4-N-diphenyl-9,9'-spirobi[fluorene]-2',4-diamine;4-N-dibenzothiophen-2-yl-2-N',4-N-diphenyl-2-N'-(3-phenylphenyl)-9,9'-spirobi[fluorene]-2',4-diamine;4-N-dibenzothiophen-2-yl-2-N',4-N-diphenyl-2-N'-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2',4-diamine;2-N',4-N-di(dibenzofuran-2-yl)-2-N',4-N-diphenyl-9,9'-spirobi[fluorene]-2',4-diamine
CID 158402025
N-[4-(5-naphthalen-1-ylnaphthalen-1-yl)phenyl]-N-(9,9'-spirobi[fluorene]-2-yl)dibenzothiophen-2-amine
CID 177114131
4-dibenzofuran-2-yl-N-(4-dibenzothiophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline;3-dibenzothiophen-2-yl-N-(3-dibenzothiophen-2-ylphenyl)-N-(4-phenylphenyl)aniline;N-(4-dibenzothiophen-2-ylphenyl)-N-naphthalen-1-yldibenzothiophen-2-amine;N-(3-dibenzothiophen-2-ylphenyl)-3-phenyl-N-(4-phenylphenyl)aniline
CID 158126974
N-[4-([1]benzothiolo[2,3-b][1]benzothiol-4-yl)phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-[4-([1]benzothiolo[3,2-b][1]benzothiol-1-yl)phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-4-phenylaniline;N-(4-dibenzofuran-2-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-phenylaniline;N-(4-dibenzofuran-4-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-phenylaniline;N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]dibenzothiophen-3-amine
CID 159740709
7-dibenzothiophen-2-yl-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-naphthalen-1-yldibenzothiophen-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-[4-(4-dibenzothiophen-2-ylphenyl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 158200664
N-(3-dibenzofuran-2-ylphenyl)-N-(3-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 118298560
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-naphthalen-1-yldibenzofuran-2-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-naphthalen-1-yldibenzothiophen-2-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-naphthalen-1-ylnaphthalen-1-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-naphthalen-1-ylnaphthalen-2-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(4-naphthalen-1-ylphenyl)naphthalen-1-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(4-phenylphenyl)naphthalen-1-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N,9,9-triphenylfluoren-2-amine
CID 157330942
N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine
CID 157349441
N-(4-dibenzofuran-2-ylphenyl)-N-phenyl-6-[2-(N-phenylanilino)-9,9'-spirobi[fluorene]-4'-yl]dibenzothiophen-2-amine
CID 164934267

Frequently Asked Questions

What is the IUPAC name of N-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-N-(4-naphtho[2,1-b][1]benzothiol-5-ylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-naphtho[2,3-b][1]benzothiol-2-yl-N-(4-phenylphenyl)dibenzofuran-2-amine?
The IUPAC name of N-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-N-(4-naphtho[2,1-b][1]benzothiol-5-ylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-naphtho[2,3-b][1]benzothiol-2-yl-N-(4-phenylphenyl)dibenzofuran-2-amine (CID 161371541) is N-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-N-(4-naphtho[2,1-b][1]benzothiol-5-ylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-naphtho[2,3-b][1]benzothiol-2-yl-N-(4-phenylphenyl)dibenzofuran-2-amine.
What is the SMILES notation for N-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-N-(4-naphtho[2,1-b][1]benzothiol-5-ylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-naphtho[2,3-b][1]benzothiol-2-yl-N-(4-phenylphenyl)dibenzofuran-2-amine?
The canonical SMILES for N-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-N-(4-naphtho[2,1-b][1]benzothiol-5-ylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-naphtho[2,3-b][1]benzothiol-2-yl-N-(4-phenylphenyl)dibenzofuran-2-amine is c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc4oc5ccccc5c4c3)c3ccc4sc5cc6ccccc6cc5c4c3)cc2)cc1.c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2ccc(N(c3ccc(-c4cccc5ccccc45)cc3)c3ccc(-c4cc5sc6ccccc6c5c5ccccc45)cc3)cc21.
What is the InChIKey of N-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-N-(4-naphtho[2,1-b][1]benzothiol-5-ylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-naphtho[2,3-b][1]benzothiol-2-yl-N-(4-phenylphenyl)dibenzofuran-2-amine?
The InChIKey is VQNGLPCAXPTXGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H39NS.C42H29NO.C40H25NOS/c1-2-16-46-40(14-1)15-13-23-47(46)41-28-32-43(33-29-41)64(44-34-30-42(31-35-44)55-39-61-62(53-21-4-3-17-48(53)55)54-22-8-12-27-60(54)65-61)45-36-37-52-51-20-7-11-26-58(51)63(59(52)38-45)56-24-9-5-18-49(56)50-19-6-10-25-57(50)63;1-3-9-30(10-4-1)32-15-22-36(23-16-32)43(37-24-17-33(18-25-37)31-11-5-2-6-12-31)38-26-19-34(20-27-38)35-21-28-42-40(29-35)39-13-7-8-14-41(39)44-42;1-2-8-26(9-3-1)27-14-16-30(17-15-27)41(31-18-20-38-34(24-31)33-12-6-7-13-37(33)42-38)32-19-21-39-36(25-32)35-22-28-10-4-5-11-29(28)23-40(35)43-39/h1-39H;1-29H;1-25H.
What are the key properties of N-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-N-(4-naphtho[2,1-b][1]benzothiol-5-ylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-naphtho[2,3-b][1]benzothiol-2-yl-N-(4-phenylphenyl)dibenzofuran-2-amine?
N-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-N-(4-naphtho[2,1-b][1]benzothiol-5-ylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-naphtho[2,3-b][1]benzothiol-2-yl-N-(4-phenylphenyl)dibenzofuran-2-amine has a molecular weight of 1973.49 g/mol, XLogP of 41.81, 15 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-N-(4-naphtho[2,1-b][1]benzothiol-5-ylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-naphtho[2,3-b][1]benzothiol-2-yl-N-(4-phenylphenyl)dibenzofuran-2-amine is sourced from PubChem (CID 161371541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).