8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine;N-(3-dibenzofuran-3-ylphenyl)-7-[2-[2-[4-(4-dibenzothiophen-2-yl-N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenyldibenzofuran-2-amine;N-dibenzothiophen-2-yl-7-[4-(4-dibenzothiophen-2-yl-N-dibenzothiophen-3-ylanilino)-3-(3-phenylphenyl)phenyl]-N-phenyldibenzofuran-1-amine

C244H160N6O5S4 — CID 167602152

IUPAC8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine;N-(3-dibenzofuran-3-ylphenyl)-7-[2-[2-[4-(4-dibenzothiophen-2-yl-N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenyldibenzofuran-2-amine;N-dibenzothiophen-2-yl-7-[4-(4-dibenzothiophen-2-yl-N-dibenzothiophen-3-ylanilino)-3-(3-phenylphenyl)phenyl]-N-phenyldibenzofuran-1-amine
SMILESCC1(C)c2ccccc2-c2cc(N(c3ccc4c(c3)-c3ccccc3C4(C)C)c3cccc4oc5ccc(-c6ccccc6-c6cccc(-c7cccc(N(c8ccccc8)c8ccc(-c9ccc%10oc%11ccccc%11c%10c9)cc8)c7)c6)cc5c34)ccc21.c1ccc(-c2cccc(-c3cc(-c4ccc5c(c4)oc4cccc(N(c6ccccc6)c6ccc7sc8ccccc8c7c6)c45)ccc3N(c3ccc(-c4ccc5sc6ccccc6c5c4)cc3)c3ccc4c(c3)sc3ccccc34)c2)cc1.c1ccc(N(c2cccc(-c3ccc4c(c3)oc3ccccc34)c2)c2ccc3oc4cc(-c5ccccc5-c5ccccc5-c5ccc(N(c6ccc(-c7ccc8sc9ccccc9c8c7)cc6)c6ccc7ccccc7c6)cc5)ccc4c3c2)cc1
InChIInChI=1S/C84H60N2O2.C82H52N2O2S.C78H48N2OS3/c1-83(2)73-30-13-10-27-66(73)69-51-62(41-43-75(69)83)86(63-42-44-76-70(52-63)67-28-11-14-31-74(67)84(76,3)4)77-32-18-34-81-82(77)72-50-58(38-46-80(72)88-81)65-26-9-8-25-64(65)57-21-16-19-54(47-57)55-20-17-24-61(48-55)85(59-22-6-5-7-23-59)60-39-35-53(36-40-60)56-37-45-79-71(49-56)68-29-12-15-33-78(68)87-79;1-2-18-61(19-3-1)84(64-20-14-17-57(48-64)59-34-43-72-71-25-10-12-27-77(71)85-79(72)50-59)66-42-45-78-75(52-66)73-44-35-60(51-80(73)86-78)68-22-7-9-24-70(68)69-23-8-6-21-67(69)55-32-39-63(40-33-55)83(65-41-31-53-15-4-5-16-56(53)47-65)62-37-29-54(30-38-62)58-36-46-82-76(49-58)74-26-11-13-28-81(74)87-82;1-3-15-49(16-4-1)51-17-13-18-55(43-51)65-44-53(54-31-38-64-71(46-54)81-70-25-14-24-69(78(64)70)80(56-19-5-2-6-20-56)58-37-42-76-67(47-58)62-23-9-12-28-74(62)83-76)32-40-68(65)79(59-36-39-63-60-21-7-10-26-72(60)84-77(63)48-59)57-34-29-50(30-35-57)52-33-41-75-66(45-52)61-22-8-11-27-73(61)82-75/h5-52H,1-4H3;1-52H;1-48H
InChIKeyJWRIXIMLXNYNAG-UHFFFAOYSA-N
MW3384.27 g/mol
LogP72.28
Rot. Bonds31

About 8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine;N-(3-dibenzofuran-3-ylphenyl)-7-[2-[2-[4-(4-dibenzothiophen-2-yl-N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenyldibenzofuran-2-amine;N-dibenzothiophen-2-yl-7-[4-(4-dibenzothiophen-2-yl-N-dibenzothiophen-3-ylanilino)-3-(3-phenylphenyl)phenyl]-N-phenyldibenzofuran-1-amine

8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine;N-(3-dibenzofuran-3-ylphenyl)-7-[2-[2-[4-(4-dibenzothiophen-2-yl-N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenyldibenzofuran-2-amine;N-dibenzothiophen-2-yl-7-[4-(4-dibenzothiophen-2-yl-N-dibenzothiophen-3-ylanilino)-3-(3-phenylphenyl)phenyl]-N-phenyldibenzofuran-1-amine (PubChem CID 167602152) has the molecular formula C244H160N6O5S4 and a molecular weight of 3384.27 g/mol. Its IUPAC name is 8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine;N-(3-dibenzofuran-3-ylphenyl)-7-[2-[2-[4-(4-dibenzothiophen-2-yl-N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenyldibenzofuran-2-amine;N-dibenzothiophen-2-yl-7-[4-(4-dibenzothiophen-2-yl-N-dibenzothiophen-3-ylanilino)-3-(3-phenylphenyl)phenyl]-N-phenyldibenzofuran-1-amine.

Molecular Properties

Compound Name8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine;N-(3-dibenzofuran-3-ylphenyl)-7-[2-[2-[4-(4-dibenzothiophen-2-yl-N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenyldibenzofuran-2-amine;N-dibenzothiophen-2-yl-7-[4-(4-dibenzothiophen-2-yl-N-dibenzothiophen-3-ylanilino)-3-(3-phenylphenyl)phenyl]-N-phenyldibenzofuran-1-amine
PubChem CID167602152
Molecular FormulaC244H160N6O5S4
Molecular Weight3384.27 g/mol
Exact Mass3381.13
IUPAC Name8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine;N-(3-dibenzofuran-3-ylphenyl)-7-[2-[2-[4-(4-dibenzothiophen-2-yl-N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenyldibenzofuran-2-amine;N-dibenzothiophen-2-yl-7-[4-(4-dibenzothiophen-2-yl-N-dibenzothiophen-3-ylanilino)-3-(3-phenylphenyl)phenyl]-N-phenyldibenzofuran-1-amine
SMILESCC1(C)c2ccccc2-c2cc(N(c3ccc4c(c3)-c3ccccc3C4(C)C)c3cccc4oc5ccc(-c6ccccc6-c6cccc(-c7cccc(N(c8ccccc8)c8ccc(-c9ccc%10oc%11ccccc%11c%10c9)cc8)c7)c6)cc5c34)ccc21.c1ccc(-c2cccc(-c3cc(-c4ccc5c(c4)oc4cccc(N(c6ccccc6)c6ccc7sc8ccccc8c7c6)c45)ccc3N(c3ccc(-c4ccc5sc6ccccc6c5c4)cc3)c3ccc4c(c3)sc3ccccc34)c2)cc1.c1ccc(N(c2cccc(-c3ccc4c(c3)oc3ccccc34)c2)c2ccc3oc4cc(-c5ccccc5-c5ccccc5-c5ccc(N(c6ccc(-c7ccc8sc9ccccc9c8c7)cc6)c6ccc7ccccc7c6)cc5)ccc4c3c2)cc1
InChIInChI=1S/C84H60N2O2.C82H52N2O2S.C78H48N2OS3/c1-83(2)73-30-13-10-27-66(73)69-51-62(41-43-75(69)83)86(63-42-44-76-70(52-63)67-28-11-14-31-74(67)84(76,3)4)77-32-18-34-81-82(77)72-50-58(38-46-80(72)88-81)65-26-9-8-25-64(65)57-21-16-19-54(47-57)55-20-17-24-61(48-55)85(59-22-6-5-7-23-59)60-39-35-53(36-40-60)56-37-45-79-71(49-56)68-29-12-15-33-78(68)87-79;1-2-18-61(19-3-1)84(64-20-14-17-57(48-64)59-34-43-72-71-25-10-12-27-77(71)85-79(72)50-59)66-42-45-78-75(52-66)73-44-35-60(51-80(73)86-78)68-22-7-9-24-70(68)69-23-8-6-21-67(69)55-32-39-63(40-33-55)83(65-41-31-53-15-4-5-16-56(53)47-65)62-37-29-54(30-38-62)58-36-46-82-76(49-58)74-26-11-13-28-81(74)87-82;1-3-15-49(16-4-1)51-17-13-18-55(43-51)65-44-53(54-31-38-64-71(46-54)81-70-25-14-24-69(78(64)70)80(56-19-5-2-6-20-56)58-37-42-76-67(47-58)62-23-9-12-28-74(62)83-76)32-40-68(65)79(59-36-39-63-60-21-7-10-26-72(60)84-77(63)48-59)57-34-29-50(30-35-57)52-33-41-75-66(45-52)61-22-8-11-27-73(61)82-75/h5-52H,1-4H3;1-52H;1-48H
InChIKeyJWRIXIMLXNYNAG-UHFFFAOYSA-N
XLogP72.28
TPSA85.14 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds31
Heavy Atoms259
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003384.27
LogP ≤ 572.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine;N-(3-dibenzofuran-3-ylphenyl)-7-[2-[2-[4-(4-dibenzothiophen-2-yl-N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenyldibenzofuran-2-amine;N-dibenzothiophen-2-yl-7-[4-(4-dibenzothiophen-2-yl-N-dibenzothiophen-3-ylanilino)-3-(3-phenylphenyl)phenyl]-N-phenyldibenzofuran-1-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine;N-(3-dibenzofuran-3-ylphenyl)-7-[2-[2-[4-(4-dibenzothiophen-2-yl-N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenyldibenzofuran-2-amine;N-dibenzothiophen-2-yl-7-[4-(4-dibenzothiophen-2-yl-N-dibenzothiophen-3-ylanilino)-3-(3-phenylphenyl)phenyl]-N-phenyldibenzofuran-1-amine?
The IUPAC name of 8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine;N-(3-dibenzofuran-3-ylphenyl)-7-[2-[2-[4-(4-dibenzothiophen-2-yl-N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenyldibenzofuran-2-amine;N-dibenzothiophen-2-yl-7-[4-(4-dibenzothiophen-2-yl-N-dibenzothiophen-3-ylanilino)-3-(3-phenylphenyl)phenyl]-N-phenyldibenzofuran-1-amine (CID 167602152) is 8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine;N-(3-dibenzofuran-3-ylphenyl)-7-[2-[2-[4-(4-dibenzothiophen-2-yl-N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenyldibenzofuran-2-amine;N-dibenzothiophen-2-yl-7-[4-(4-dibenzothiophen-2-yl-N-dibenzothiophen-3-ylanilino)-3-(3-phenylphenyl)phenyl]-N-phenyldibenzofuran-1-amine.
What is the SMILES notation for 8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine;N-(3-dibenzofuran-3-ylphenyl)-7-[2-[2-[4-(4-dibenzothiophen-2-yl-N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenyldibenzofuran-2-amine;N-dibenzothiophen-2-yl-7-[4-(4-dibenzothiophen-2-yl-N-dibenzothiophen-3-ylanilino)-3-(3-phenylphenyl)phenyl]-N-phenyldibenzofuran-1-amine?
The canonical SMILES for 8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine;N-(3-dibenzofuran-3-ylphenyl)-7-[2-[2-[4-(4-dibenzothiophen-2-yl-N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenyldibenzofuran-2-amine;N-dibenzothiophen-2-yl-7-[4-(4-dibenzothiophen-2-yl-N-dibenzothiophen-3-ylanilino)-3-(3-phenylphenyl)phenyl]-N-phenyldibenzofuran-1-amine is CC1(C)c2ccccc2-c2cc(N(c3ccc4c(c3)-c3ccccc3C4(C)C)c3cccc4oc5ccc(-c6ccccc6-c6cccc(-c7cccc(N(c8ccccc8)c8ccc(-c9ccc%10oc%11ccccc%11c%10c9)cc8)c7)c6)cc5c34)ccc21.c1ccc(-c2cccc(-c3cc(-c4ccc5c(c4)oc4cccc(N(c6ccccc6)c6ccc7sc8ccccc8c7c6)c45)ccc3N(c3ccc(-c4ccc5sc6ccccc6c5c4)cc3)c3ccc4c(c3)sc3ccccc34)c2)cc1.c1ccc(N(c2cccc(-c3ccc4c(c3)oc3ccccc34)c2)c2ccc3oc4cc(-c5ccccc5-c5ccccc5-c5ccc(N(c6ccc(-c7ccc8sc9ccccc9c8c7)cc6)c6ccc7ccccc7c6)cc5)ccc4c3c2)cc1.
What is the InChIKey of 8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine;N-(3-dibenzofuran-3-ylphenyl)-7-[2-[2-[4-(4-dibenzothiophen-2-yl-N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenyldibenzofuran-2-amine;N-dibenzothiophen-2-yl-7-[4-(4-dibenzothiophen-2-yl-N-dibenzothiophen-3-ylanilino)-3-(3-phenylphenyl)phenyl]-N-phenyldibenzofuran-1-amine?
The InChIKey is JWRIXIMLXNYNAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C84H60N2O2.C82H52N2O2S.C78H48N2OS3/c1-83(2)73-30-13-10-27-66(73)69-51-62(41-43-75(69)83)86(63-42-44-76-70(52-63)67-28-11-14-31-74(67)84(76,3)4)77-32-18-34-81-82(77)72-50-58(38-46-80(72)88-81)65-26-9-8-25-64(65)57-21-16-19-54(47-57)55-20-17-24-61(48-55)85(59-22-6-5-7-23-59)60-39-35-53(36-40-60)56-37-45-79-71(49-56)68-29-12-15-33-78(68)87-79;1-2-18-61(19-3-1)84(64-20-14-17-57(48-64)59-34-43-72-71-25-10-12-27-77(71)85-79(72)50-59)66-42-45-78-75(52-66)73-44-35-60(51-80(73)86-78)68-22-7-9-24-70(68)69-23-8-6-21-67(69)55-32-39-63(40-33-55)83(65-41-31-53-15-4-5-16-56(53)47-65)62-37-29-54(30-38-62)58-36-46-82-76(49-58)74-26-11-13-28-81(74)87-82;1-3-15-49(16-4-1)51-17-13-18-55(43-51)65-44-53(54-31-38-64-71(46-54)81-70-25-14-24-69(78(64)70)80(56-19-5-2-6-20-56)58-37-42-76-67(47-58)62-23-9-12-28-74(62)83-76)32-40-68(65)79(59-36-39-63-60-21-7-10-26-72(60)84-77(63)48-59)57-34-29-50(30-35-57)52-33-41-75-66(45-52)61-22-8-11-27-73(61)82-75/h5-52H,1-4H3;1-52H;1-48H.
What are the key properties of 8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine;N-(3-dibenzofuran-3-ylphenyl)-7-[2-[2-[4-(4-dibenzothiophen-2-yl-N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenyldibenzofuran-2-amine;N-dibenzothiophen-2-yl-7-[4-(4-dibenzothiophen-2-yl-N-dibenzothiophen-3-ylanilino)-3-(3-phenylphenyl)phenyl]-N-phenyldibenzofuran-1-amine?
8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine;N-(3-dibenzofuran-3-ylphenyl)-7-[2-[2-[4-(4-dibenzothiophen-2-yl-N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenyldibenzofuran-2-amine;N-dibenzothiophen-2-yl-7-[4-(4-dibenzothiophen-2-yl-N-dibenzothiophen-3-ylanilino)-3-(3-phenylphenyl)phenyl]-N-phenyldibenzofuran-1-amine has a molecular weight of 3384.27 g/mol, XLogP of 72.28, 31 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine;N-(3-dibenzofuran-3-ylphenyl)-7-[2-[2-[4-(4-dibenzothiophen-2-yl-N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenyldibenzofuran-2-amine;N-dibenzothiophen-2-yl-7-[4-(4-dibenzothiophen-2-yl-N-dibenzothiophen-3-ylanilino)-3-(3-phenylphenyl)phenyl]-N-phenyldibenzofuran-1-amine is sourced from PubChem (CID 167602152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).