3-N-dibenzothiophen-2-yl-3-N-(9-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenylbenzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(4-phenylphenyl)benzene-1,3-diamine;3-N-(3,5-diphenylphenyl)-3-N-naphthalen-2-yl-1-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(3-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]benzene-1,3-diamine

C304H204N14O4S3 — CID 158792080

IUPAC3-N-dibenzothiophen-2-yl-3-N-(9-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenylbenzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(4-phenylphenyl)benzene-1,3-diamine;3-N-(3,5-diphenylphenyl)-3-N-naphthalen-2-yl-1-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(3-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]benzene-1,3-diamine
SMILESc1ccc(-c2ccc(N(c3cccc(N(c4ccccc4)c4ccccc4)c3)c3ccc4oc5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccccc3)c3cccc(N(c4ccccc4)c4ccc5oc6ccc(-c7ccc8c9ccccc9n(-c9ccccc9)c8c7)cc6c5c4)c3)cc2)cc1.c1ccc(-c2cccc(N(c3cccc(N(c4cc(-c5ccccc5)cc(-c5ccccc5)c4)c4ccc5ccccc5c4)c3)c3ccc4oc5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c4c3)c2)cc1.c1ccc(N(c2ccccc2)c2cccc(N(c3ccc4sc5ccccc5c4c3)c3ccc4sc5cccc(-c6ccc7sc8ccccc8c7c6)c5c4c3)c2)cc1.c1ccc(N(c2ccccc2)c2cccc(N(c3ccccc3)c3ccc4oc5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c4c3)c2)cc1
InChIInChI=1S/C76H51N3O.2C60H41N3O.C54H37N3O.C54H34N2S3/c1-5-19-52(20-6-1)57-27-17-30-63(44-57)77(67-39-42-76-72(51-67)71-48-58(37-41-75(71)80-76)59-36-40-70-69-33-15-16-34-73(69)79(74(70)49-59)62-28-11-4-12-29-62)64-31-18-32-65(50-64)78(66-38-35-55-25-13-14-26-56(55)45-66)68-46-60(53-21-7-2-8-22-53)43-61(47-68)54-23-9-3-10-24-54;1-5-16-42(17-6-1)43-28-32-49(33-29-43)61(46-18-7-2-8-19-46)50-24-15-25-51(40-50)62(47-20-9-3-10-21-47)52-34-37-60-56(41-52)55-38-44(31-36-59(55)64-60)45-30-35-54-53-26-13-14-27-57(53)63(58(54)39-45)48-22-11-4-12-23-48;1-5-16-42(17-6-1)43-28-32-49(33-29-43)62(51-25-15-24-50(40-51)61(46-18-7-2-8-19-46)47-20-9-3-10-21-47)52-34-37-60-56(41-52)55-38-44(31-36-59(55)64-60)45-30-35-54-53-26-13-14-27-57(53)63(58(54)39-45)48-22-11-4-12-23-48;1-5-16-40(17-6-1)55(41-18-7-2-8-19-41)44-24-15-25-45(36-44)56(42-20-9-3-10-21-42)46-30-33-54-50(37-46)49-34-38(29-32-53(49)58-54)39-28-31-48-47-26-13-14-27-51(47)57(52(48)35-39)43-22-11-4-12-23-43;1-3-13-36(14-4-1)55(37-15-5-2-6-16-37)38-17-11-18-39(32-38)56(40-26-29-51-46(33-40)44-20-8-10-23-49(44)58-51)41-27-30-52-47(34-41)54-42(21-12-24-53(54)59-52)35-25-28-50-45(31-35)43-19-7-9-22-48(43)57-50/h1-51H;2*1-41H;1-37H;1-34H
InChIKeyISKDCPFMAAOOPX-UHFFFAOYSA-N
MW4213.27 g/mol
LogP88.04
Rot. Bonds44

About 3-N-dibenzothiophen-2-yl-3-N-(9-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenylbenzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(4-phenylphenyl)benzene-1,3-diamine;3-N-(3,5-diphenylphenyl)-3-N-naphthalen-2-yl-1-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(3-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]benzene-1,3-diamine

3-N-dibenzothiophen-2-yl-3-N-(9-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenylbenzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(4-phenylphenyl)benzene-1,3-diamine;3-N-(3,5-diphenylphenyl)-3-N-naphthalen-2-yl-1-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(3-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]benzene-1,3-diamine (PubChem CID 158792080) has the molecular formula C304H204N14O4S3 and a molecular weight of 4213.27 g/mol. Its IUPAC name is 3-N-dibenzothiophen-2-yl-3-N-(9-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenylbenzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(4-phenylphenyl)benzene-1,3-diamine;3-N-(3,5-diphenylphenyl)-3-N-naphthalen-2-yl-1-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(3-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]benzene-1,3-diamine.

Molecular Properties

Compound Name3-N-dibenzothiophen-2-yl-3-N-(9-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenylbenzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(4-phenylphenyl)benzene-1,3-diamine;3-N-(3,5-diphenylphenyl)-3-N-naphthalen-2-yl-1-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(3-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]benzene-1,3-diamine
PubChem CID158792080
Molecular FormulaC304H204N14O4S3
Molecular Weight4213.27 g/mol
Exact Mass4209.54
IUPAC Name3-N-dibenzothiophen-2-yl-3-N-(9-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenylbenzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(4-phenylphenyl)benzene-1,3-diamine;3-N-(3,5-diphenylphenyl)-3-N-naphthalen-2-yl-1-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(3-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]benzene-1,3-diamine
SMILESc1ccc(-c2ccc(N(c3cccc(N(c4ccccc4)c4ccccc4)c3)c3ccc4oc5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccccc3)c3cccc(N(c4ccccc4)c4ccc5oc6ccc(-c7ccc8c9ccccc9n(-c9ccccc9)c8c7)cc6c5c4)c3)cc2)cc1.c1ccc(-c2cccc(N(c3cccc(N(c4cc(-c5ccccc5)cc(-c5ccccc5)c4)c4ccc5ccccc5c4)c3)c3ccc4oc5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c4c3)c2)cc1.c1ccc(N(c2ccccc2)c2cccc(N(c3ccc4sc5ccccc5c4c3)c3ccc4sc5cccc(-c6ccc7sc8ccccc8c7c6)c5c4c3)c2)cc1.c1ccc(N(c2ccccc2)c2cccc(N(c3ccccc3)c3ccc4oc5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c4c3)c2)cc1
InChIInChI=1S/C76H51N3O.2C60H41N3O.C54H37N3O.C54H34N2S3/c1-5-19-52(20-6-1)57-27-17-30-63(44-57)77(67-39-42-76-72(51-67)71-48-58(37-41-75(71)80-76)59-36-40-70-69-33-15-16-34-73(69)79(74(70)49-59)62-28-11-4-12-29-62)64-31-18-32-65(50-64)78(66-38-35-55-25-13-14-26-56(55)45-66)68-46-60(53-21-7-2-8-22-53)43-61(47-68)54-23-9-3-10-24-54;1-5-16-42(17-6-1)43-28-32-49(33-29-43)61(46-18-7-2-8-19-46)50-24-15-25-51(40-50)62(47-20-9-3-10-21-47)52-34-37-60-56(41-52)55-38-44(31-36-59(55)64-60)45-30-35-54-53-26-13-14-27-57(53)63(58(54)39-45)48-22-11-4-12-23-48;1-5-16-42(17-6-1)43-28-32-49(33-29-43)62(51-25-15-24-50(40-51)61(46-18-7-2-8-19-46)47-20-9-3-10-21-47)52-34-37-60-56(41-52)55-38-44(31-36-59(55)64-60)45-30-35-54-53-26-13-14-27-57(53)63(58(54)39-45)48-22-11-4-12-23-48;1-5-16-40(17-6-1)55(41-18-7-2-8-19-41)44-24-15-25-45(36-44)56(42-20-9-3-10-21-42)46-30-33-54-50(37-46)49-34-38(29-32-53(49)58-54)39-28-31-48-47-26-13-14-27-51(47)57(52(48)35-39)43-22-11-4-12-23-43;1-3-13-36(14-4-1)55(37-15-5-2-6-16-37)38-17-11-18-39(32-38)56(40-26-29-51-46(33-40)44-20-8-10-23-49(44)58-51)41-27-30-52-47(34-41)54-42(21-12-24-53(54)59-52)35-25-28-50-45(31-35)43-19-7-9-22-48(43)57-50/h1-51H;2*1-41H;1-37H;1-34H
InChIKeyISKDCPFMAAOOPX-UHFFFAOYSA-N
XLogP88.04
TPSA104.68 Ų
H-Bond Donors
H-Bond Acceptors21
Rotatable Bonds44
Heavy Atoms325
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004213.27
LogP ≤ 588.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1021

Analyze 3-N-dibenzothiophen-2-yl-3-N-(9-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenylbenzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(4-phenylphenyl)benzene-1,3-diamine;3-N-(3,5-diphenylphenyl)-3-N-naphthalen-2-yl-1-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(3-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]benzene-1,3-diamine with MolForge

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Related Compounds

3-N-dibenzofuran-2-yl-5-dibenzothiophen-3-yl-1-N-phenanthren-9-yl-1-N-phenyl-3-N-[3-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-4-yl]phenyl]benzene-1,3-diamine;3-N-dibenzothiophen-3-yl-1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-4-yl]benzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-4-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;3-N-(3,5-diphenylphenyl)-1-N-naphthalen-2-yl-1-N,5-diphenyl-3-N-[4-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-4-yl]phenyl]benzene-1,3-diamine
CID 159660047
N-phenyl-N-[3-(9-phenylcarbazol-2-yl)-5-(6-phenylnaphthalen-2-yl)phenyl]dibenzothiophen-2-amine
CID 118349368
N-[3-[2-[3-[dibenzofuran-2-yl(naphthalen-2-yl)amino]phenyl]phenyl]phenyl]-N-naphthalen-2-yldibenzofuran-2-amine;N-[4-[3-[4-(N-dibenzothiophen-2-ylanilino)phenyl]phenyl]phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-4-amine;N-[3-[3-[3-(N-naphthalen-1-ylanilino)phenyl]phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[3-[4-[3-(N-naphthalen-1-ylanilino)phenyl]phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[2-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 165072526
N-[3-naphthalen-1-yl-5-(9-phenylcarbazol-2-yl)phenyl]-N-phenyldibenzothiophen-2-amine
CID 144990462
5-[7-[dibenzothiophen-2-yl(naphthalen-2-yl)amino]-9-phenylcarbazol-3-yl]-1-N,1-N,3-N,3-N-tetraphenylbenzene-1,3-diamine
CID 146588754
1-N-[4-[4-[3-[4-[N-dibenzothiophen-3-yl-3-naphthalen-2-yl-5-(4-phenyl-N-(4-phenylphenyl)anilino)anilino]phenyl]phenyl]phenyl]phenyl]-5-naphthalen-2-yl-3-N-(9-phenylcarbazol-3-yl)-1-N,3-N-bis(4-phenylphenyl)benzene-1,3-diamine
CID 146664119
N-naphthalen-2-yl-N-[4-[2-(9-phenylcarbazol-4-yl)carbazol-9-yl]phenyl]dibenzothiophen-2-amine
CID 163874479
N-[3-carbazol-9-yl-5-(9-phenylcarbazol-2-yl)phenyl]-N-naphthalen-2-yldibenzothiophen-2-amine
CID 144888534
3-N-(8-dibenzothiophen-3-yldibenzothiophen-3-yl)-1-N,1-N-diphenyl-3-N-(4-phenylphenyl)benzene-1,3-diamine;3-N-dibenzothiophen-2-yl-1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-3-yl]benzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-3-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-3-yl]-1-N-(4-phenylphenyl)benzene-1,3-diamine
CID 157137830
1-N,3-N-di(dibenzothiophen-2-yl)-1-N,3-N-dinaphthalen-2-yl-5-(9-phenylcarbazol-3-yl)benzene-1,3-diamine
CID 88873441
N-naphthalen-1-yl-8-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-[3-(8-phenyldibenzothiophen-2-yl)phenyl]phenyl]naphthalen-1-amine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-(N-(6-phenyldibenzofuran-3-yl)anilino)phenyl]benzene-1,3-diamine
CID 158069740
N-[3-[2-dibenzofuran-2-yl-4-(9-phenylcarbazol-2-yl)phenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 121443674

Frequently Asked Questions

What is the IUPAC name of 3-N-dibenzothiophen-2-yl-3-N-(9-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenylbenzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(4-phenylphenyl)benzene-1,3-diamine;3-N-(3,5-diphenylphenyl)-3-N-naphthalen-2-yl-1-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(3-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]benzene-1,3-diamine?
The IUPAC name of 3-N-dibenzothiophen-2-yl-3-N-(9-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenylbenzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(4-phenylphenyl)benzene-1,3-diamine;3-N-(3,5-diphenylphenyl)-3-N-naphthalen-2-yl-1-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(3-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]benzene-1,3-diamine (CID 158792080) is 3-N-dibenzothiophen-2-yl-3-N-(9-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenylbenzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(4-phenylphenyl)benzene-1,3-diamine;3-N-(3,5-diphenylphenyl)-3-N-naphthalen-2-yl-1-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(3-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]benzene-1,3-diamine.
What is the SMILES notation for 3-N-dibenzothiophen-2-yl-3-N-(9-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenylbenzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(4-phenylphenyl)benzene-1,3-diamine;3-N-(3,5-diphenylphenyl)-3-N-naphthalen-2-yl-1-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(3-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]benzene-1,3-diamine?
The canonical SMILES for 3-N-dibenzothiophen-2-yl-3-N-(9-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenylbenzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(4-phenylphenyl)benzene-1,3-diamine;3-N-(3,5-diphenylphenyl)-3-N-naphthalen-2-yl-1-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(3-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]benzene-1,3-diamine is c1ccc(-c2ccc(N(c3cccc(N(c4ccccc4)c4ccccc4)c3)c3ccc4oc5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccccc3)c3cccc(N(c4ccccc4)c4ccc5oc6ccc(-c7ccc8c9ccccc9n(-c9ccccc9)c8c7)cc6c5c4)c3)cc2)cc1.c1ccc(-c2cccc(N(c3cccc(N(c4cc(-c5ccccc5)cc(-c5ccccc5)c4)c4ccc5ccccc5c4)c3)c3ccc4oc5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c4c3)c2)cc1.c1ccc(N(c2ccccc2)c2cccc(N(c3ccc4sc5ccccc5c4c3)c3ccc4sc5cccc(-c6ccc7sc8ccccc8c7c6)c5c4c3)c2)cc1.c1ccc(N(c2ccccc2)c2cccc(N(c3ccccc3)c3ccc4oc5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c4c3)c2)cc1.
What is the InChIKey of 3-N-dibenzothiophen-2-yl-3-N-(9-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenylbenzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(4-phenylphenyl)benzene-1,3-diamine;3-N-(3,5-diphenylphenyl)-3-N-naphthalen-2-yl-1-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(3-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]benzene-1,3-diamine?
The InChIKey is ISKDCPFMAAOOPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C76H51N3O.2C60H41N3O.C54H37N3O.C54H34N2S3/c1-5-19-52(20-6-1)57-27-17-30-63(44-57)77(67-39-42-76-72(51-67)71-48-58(37-41-75(71)80-76)59-36-40-70-69-33-15-16-34-73(69)79(74(70)49-59)62-28-11-4-12-29-62)64-31-18-32-65(50-64)78(66-38-35-55-25-13-14-26-56(55)45-66)68-46-60(53-21-7-2-8-22-53)43-61(47-68)54-23-9-3-10-24-54;1-5-16-42(17-6-1)43-28-32-49(33-29-43)61(46-18-7-2-8-19-46)50-24-15-25-51(40-50)62(47-20-9-3-10-21-47)52-34-37-60-56(41-52)55-38-44(31-36-59(55)64-60)45-30-35-54-53-26-13-14-27-57(53)63(58(54)39-45)48-22-11-4-12-23-48;1-5-16-42(17-6-1)43-28-32-49(33-29-43)62(51-25-15-24-50(40-51)61(46-18-7-2-8-19-46)47-20-9-3-10-21-47)52-34-37-60-56(41-52)55-38-44(31-36-59(55)64-60)45-30-35-54-53-26-13-14-27-57(53)63(58(54)39-45)48-22-11-4-12-23-48;1-5-16-40(17-6-1)55(41-18-7-2-8-19-41)44-24-15-25-45(36-44)56(42-20-9-3-10-21-42)46-30-33-54-50(37-46)49-34-38(29-32-53(49)58-54)39-28-31-48-47-26-13-14-27-51(47)57(52(48)35-39)43-22-11-4-12-23-43;1-3-13-36(14-4-1)55(37-15-5-2-6-16-37)38-17-11-18-39(32-38)56(40-26-29-51-46(33-40)44-20-8-10-23-49(44)58-51)41-27-30-52-47(34-41)54-42(21-12-24-53(54)59-52)35-25-28-50-45(31-35)43-19-7-9-22-48(43)57-50/h1-51H;2*1-41H;1-37H;1-34H.
What are the key properties of 3-N-dibenzothiophen-2-yl-3-N-(9-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenylbenzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(4-phenylphenyl)benzene-1,3-diamine;3-N-(3,5-diphenylphenyl)-3-N-naphthalen-2-yl-1-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(3-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]benzene-1,3-diamine?
3-N-dibenzothiophen-2-yl-3-N-(9-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenylbenzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(4-phenylphenyl)benzene-1,3-diamine;3-N-(3,5-diphenylphenyl)-3-N-naphthalen-2-yl-1-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(3-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]benzene-1,3-diamine has a molecular weight of 4213.27 g/mol, XLogP of 88.04, 44 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-dibenzothiophen-2-yl-3-N-(9-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenylbenzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(4-phenylphenyl)benzene-1,3-diamine;3-N-(3,5-diphenylphenyl)-3-N-naphthalen-2-yl-1-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]-1-N-(3-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzofuran-2-yl]benzene-1,3-diamine is sourced from PubChem (CID 158792080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).