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

C360H237N17OS10 — CID 159360188

IUPAC1-N-dibenzofuran-4-yl-3-N-dibenzothiophen-3-yl-1-N-phenyl-3-N-[2-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]phenyl]benzene-1,3-diamine;3-N-(8-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenyl-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N-dibenzothiophen-3-yl-1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;3-N-dibenzothiophen-2-yl-1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]benzene-1,3-diamine
SMILESc1ccc(-c2ccc(N(c3cccc(N(c4ccccc4)c4ccccc4)c3)c3ccc4sc5ccc(-c6ccc7sc8ccccc8c7c6)cc5c4c3)cc2)cc1.c1ccc(-c2ccc(N(c3cccc(N(c4ccccc4)c4ccccc4)c3)c3cccc4sc5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c34)cc2)cc1.c1ccc(N(c2cccc(N(c3ccc4c(c3)sc3ccccc34)c3ccccc3-c3cccc4sc5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c34)c2)c2cccc3c2oc2ccccc23)cc1.c1ccc(N(c2cccc(N(c3ccccc3)c3cccc4sc5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c34)c2)c2ccc3c(c2)sc2ccccc23)cc1.c1ccc(N(c2ccccc2)c2cccc(N(c3ccc4sc5ccccc5c4c3)c3cccc4sc5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c34)c2)cc1.c1ccc(N(c2ccccc2)c2cccc(N(c3ccccc3)c3ccc4sc5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc5c4c3)c2)cc1
InChIInChI=1S/C72H45N3OS2.2C60H39N3S2.C60H41N3S.C54H37N3S.C54H36N2S2/c1-3-18-48(19-4-1)73(64-32-16-29-60-56-26-9-13-33-66(56)76-72(60)64)50-22-15-23-51(44-50)74(52-38-40-58-57-27-10-14-34-67(57)78-70(58)45-52)62-30-11-8-25-54(62)59-28-17-35-69-71(59)61-42-46(37-41-68(61)77-69)47-36-39-55-53-24-7-12-31-63(53)75(65(55)43-47)49-20-5-2-6-21-49;1-4-16-42(17-5-1)61(47-32-34-51-50-25-11-13-28-56(50)65-59(51)39-47)45-22-14-23-46(38-45)62(43-18-6-2-7-19-43)54-27-15-29-58-60(54)52-36-40(31-35-57(52)64-58)41-30-33-49-48-24-10-12-26-53(48)63(55(49)37-41)44-20-8-3-9-21-44;1-4-16-42(17-5-1)61(43-18-6-2-7-19-43)45-22-14-23-46(38-45)62(47-32-35-57-51(39-47)50-25-11-13-28-56(50)64-57)54-27-15-29-59-60(54)52-36-40(31-34-58(52)65-59)41-30-33-49-48-24-10-12-26-53(48)63(55(49)37-41)44-20-8-3-9-21-44;1-5-17-42(18-6-1)43-31-35-49(36-32-43)62(51-26-15-25-50(41-51)61(46-19-7-2-8-20-46)47-21-9-3-10-22-47)56-29-16-30-59-60(56)54-39-44(34-38-58(54)64-59)45-33-37-53-52-27-13-14-28-55(52)63(57(53)40-45)48-23-11-4-12-24-48;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)49-35-39(29-32-53(49)58-54)38-28-31-52-48(34-38)47-26-13-14-27-51(47)57(52)43-22-11-4-12-23-43;1-4-13-37(14-5-1)38-23-27-43(28-24-38)56(45-20-12-19-44(35-45)55(41-15-6-2-7-16-41)42-17-8-3-9-18-42)46-29-32-54-50(36-46)49-34-40(26-31-53(49)58-54)39-25-30-52-48(33-39)47-21-10-11-22-51(47)57-52/h1-45H;2*1-39H;1-41H;1-37H;1-36H
InChIKeyLILALCAQSMYTNG-UHFFFAOYSA-N
MW5137.64 g/mol
LogP107.82
Rot. Bonds50

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

1-N-dibenzofuran-4-yl-3-N-dibenzothiophen-3-yl-1-N-phenyl-3-N-[2-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]phenyl]benzene-1,3-diamine;3-N-(8-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenyl-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N-dibenzothiophen-3-yl-1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;3-N-dibenzothiophen-2-yl-1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]benzene-1,3-diamine (PubChem CID 159360188) has the molecular formula C360H237N17OS10 and a molecular weight of 5137.64 g/mol. Its IUPAC name is 1-N-dibenzofuran-4-yl-3-N-dibenzothiophen-3-yl-1-N-phenyl-3-N-[2-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]phenyl]benzene-1,3-diamine;3-N-(8-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenyl-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N-dibenzothiophen-3-yl-1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;3-N-dibenzothiophen-2-yl-1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]benzene-1,3-diamine.

Molecular Properties

Compound Name1-N-dibenzofuran-4-yl-3-N-dibenzothiophen-3-yl-1-N-phenyl-3-N-[2-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]phenyl]benzene-1,3-diamine;3-N-(8-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenyl-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N-dibenzothiophen-3-yl-1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;3-N-dibenzothiophen-2-yl-1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]benzene-1,3-diamine
PubChem CID159360188
Molecular FormulaC360H237N17OS10
Molecular Weight5137.64 g/mol
Exact Mass5132.62
IUPAC Name1-N-dibenzofuran-4-yl-3-N-dibenzothiophen-3-yl-1-N-phenyl-3-N-[2-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]phenyl]benzene-1,3-diamine;3-N-(8-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenyl-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N-dibenzothiophen-3-yl-1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;3-N-dibenzothiophen-2-yl-1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]benzene-1,3-diamine
SMILESc1ccc(-c2ccc(N(c3cccc(N(c4ccccc4)c4ccccc4)c3)c3ccc4sc5ccc(-c6ccc7sc8ccccc8c7c6)cc5c4c3)cc2)cc1.c1ccc(-c2ccc(N(c3cccc(N(c4ccccc4)c4ccccc4)c3)c3cccc4sc5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c34)cc2)cc1.c1ccc(N(c2cccc(N(c3ccc4c(c3)sc3ccccc34)c3ccccc3-c3cccc4sc5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c34)c2)c2cccc3c2oc2ccccc23)cc1.c1ccc(N(c2cccc(N(c3ccccc3)c3cccc4sc5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c34)c2)c2ccc3c(c2)sc2ccccc23)cc1.c1ccc(N(c2ccccc2)c2cccc(N(c3ccc4sc5ccccc5c4c3)c3cccc4sc5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c34)c2)cc1.c1ccc(N(c2ccccc2)c2cccc(N(c3ccccc3)c3ccc4sc5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc5c4c3)c2)cc1
InChIInChI=1S/C72H45N3OS2.2C60H39N3S2.C60H41N3S.C54H37N3S.C54H36N2S2/c1-3-18-48(19-4-1)73(64-32-16-29-60-56-26-9-13-33-66(56)76-72(60)64)50-22-15-23-51(44-50)74(52-38-40-58-57-27-10-14-34-67(57)78-70(58)45-52)62-30-11-8-25-54(62)59-28-17-35-69-71(59)61-42-46(37-41-68(61)77-69)47-36-39-55-53-24-7-12-31-63(53)75(65(55)43-47)49-20-5-2-6-21-49;1-4-16-42(17-5-1)61(47-32-34-51-50-25-11-13-28-56(50)65-59(51)39-47)45-22-14-23-46(38-45)62(43-18-6-2-7-19-43)54-27-15-29-58-60(54)52-36-40(31-35-57(52)64-58)41-30-33-49-48-24-10-12-26-53(48)63(55(49)37-41)44-20-8-3-9-21-44;1-4-16-42(17-5-1)61(43-18-6-2-7-19-43)45-22-14-23-46(38-45)62(47-32-35-57-51(39-47)50-25-11-13-28-56(50)64-57)54-27-15-29-59-60(54)52-36-40(31-34-58(52)65-59)41-30-33-49-48-24-10-12-26-53(48)63(55(49)37-41)44-20-8-3-9-21-44;1-5-17-42(18-6-1)43-31-35-49(36-32-43)62(51-26-15-25-50(41-51)61(46-19-7-2-8-20-46)47-21-9-3-10-22-47)56-29-16-30-59-60(56)54-39-44(34-38-58(54)64-59)45-33-37-53-52-27-13-14-28-55(52)63(57(53)40-45)48-23-11-4-12-24-48;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)49-35-39(29-32-53(49)58-54)38-28-31-52-48(34-38)47-26-13-14-27-51(47)57(52)43-22-11-4-12-23-43;1-4-13-37(14-5-1)38-23-27-43(28-24-38)56(45-20-12-19-44(35-45)55(41-15-6-2-7-16-41)42-17-8-3-9-18-42)46-29-32-54-50(36-46)49-34-40(26-31-53(49)58-54)39-25-30-52-48(33-39)47-21-10-11-22-51(47)57-52/h1-45H;2*1-39H;1-41H;1-37H;1-36H
InChIKeyLILALCAQSMYTNG-UHFFFAOYSA-N
XLogP107.82
TPSA76.67 Ų
H-Bond Donors
H-Bond Acceptors28
Rotatable Bonds50
Heavy Atoms388
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005137.64
LogP ≤ 5107.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1028

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

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Frequently Asked Questions

What is the IUPAC name of 1-N-dibenzofuran-4-yl-3-N-dibenzothiophen-3-yl-1-N-phenyl-3-N-[2-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]phenyl]benzene-1,3-diamine;3-N-(8-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenyl-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N-dibenzothiophen-3-yl-1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;3-N-dibenzothiophen-2-yl-1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]benzene-1,3-diamine?
The IUPAC name of 1-N-dibenzofuran-4-yl-3-N-dibenzothiophen-3-yl-1-N-phenyl-3-N-[2-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]phenyl]benzene-1,3-diamine;3-N-(8-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenyl-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N-dibenzothiophen-3-yl-1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;3-N-dibenzothiophen-2-yl-1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]benzene-1,3-diamine (CID 159360188) is 1-N-dibenzofuran-4-yl-3-N-dibenzothiophen-3-yl-1-N-phenyl-3-N-[2-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]phenyl]benzene-1,3-diamine;3-N-(8-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenyl-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N-dibenzothiophen-3-yl-1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;3-N-dibenzothiophen-2-yl-1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]benzene-1,3-diamine.
What is the SMILES notation for 1-N-dibenzofuran-4-yl-3-N-dibenzothiophen-3-yl-1-N-phenyl-3-N-[2-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]phenyl]benzene-1,3-diamine;3-N-(8-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenyl-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N-dibenzothiophen-3-yl-1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;3-N-dibenzothiophen-2-yl-1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]benzene-1,3-diamine?
The canonical SMILES for 1-N-dibenzofuran-4-yl-3-N-dibenzothiophen-3-yl-1-N-phenyl-3-N-[2-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]phenyl]benzene-1,3-diamine;3-N-(8-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenyl-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N-dibenzothiophen-3-yl-1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;3-N-dibenzothiophen-2-yl-1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]benzene-1,3-diamine is c1ccc(-c2ccc(N(c3cccc(N(c4ccccc4)c4ccccc4)c3)c3ccc4sc5ccc(-c6ccc7sc8ccccc8c7c6)cc5c4c3)cc2)cc1.c1ccc(-c2ccc(N(c3cccc(N(c4ccccc4)c4ccccc4)c3)c3cccc4sc5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c34)cc2)cc1.c1ccc(N(c2cccc(N(c3ccc4c(c3)sc3ccccc34)c3ccccc3-c3cccc4sc5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c34)c2)c2cccc3c2oc2ccccc23)cc1.c1ccc(N(c2cccc(N(c3ccccc3)c3cccc4sc5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c34)c2)c2ccc3c(c2)sc2ccccc23)cc1.c1ccc(N(c2ccccc2)c2cccc(N(c3ccc4sc5ccccc5c4c3)c3cccc4sc5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)cc5c34)c2)cc1.c1ccc(N(c2ccccc2)c2cccc(N(c3ccccc3)c3ccc4sc5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc5c4c3)c2)cc1.
What is the InChIKey of 1-N-dibenzofuran-4-yl-3-N-dibenzothiophen-3-yl-1-N-phenyl-3-N-[2-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]phenyl]benzene-1,3-diamine;3-N-(8-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenyl-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N-dibenzothiophen-3-yl-1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;3-N-dibenzothiophen-2-yl-1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]benzene-1,3-diamine?
The InChIKey is LILALCAQSMYTNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C72H45N3OS2.2C60H39N3S2.C60H41N3S.C54H37N3S.C54H36N2S2/c1-3-18-48(19-4-1)73(64-32-16-29-60-56-26-9-13-33-66(56)76-72(60)64)50-22-15-23-51(44-50)74(52-38-40-58-57-27-10-14-34-67(57)78-70(58)45-52)62-30-11-8-25-54(62)59-28-17-35-69-71(59)61-42-46(37-41-68(61)77-69)47-36-39-55-53-24-7-12-31-63(53)75(65(55)43-47)49-20-5-2-6-21-49;1-4-16-42(17-5-1)61(47-32-34-51-50-25-11-13-28-56(50)65-59(51)39-47)45-22-14-23-46(38-45)62(43-18-6-2-7-19-43)54-27-15-29-58-60(54)52-36-40(31-35-57(52)64-58)41-30-33-49-48-24-10-12-26-53(48)63(55(49)37-41)44-20-8-3-9-21-44;1-4-16-42(17-5-1)61(43-18-6-2-7-19-43)45-22-14-23-46(38-45)62(47-32-35-57-51(39-47)50-25-11-13-28-56(50)64-57)54-27-15-29-59-60(54)52-36-40(31-34-58(52)65-59)41-30-33-49-48-24-10-12-26-53(48)63(55(49)37-41)44-20-8-3-9-21-44;1-5-17-42(18-6-1)43-31-35-49(36-32-43)62(51-26-15-25-50(41-51)61(46-19-7-2-8-20-46)47-21-9-3-10-22-47)56-29-16-30-59-60(56)54-39-44(34-38-58(54)64-59)45-33-37-53-52-27-13-14-28-55(52)63(57(53)40-45)48-23-11-4-12-24-48;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)49-35-39(29-32-53(49)58-54)38-28-31-52-48(34-38)47-26-13-14-27-51(47)57(52)43-22-11-4-12-23-43;1-4-13-37(14-5-1)38-23-27-43(28-24-38)56(45-20-12-19-44(35-45)55(41-15-6-2-7-16-41)42-17-8-3-9-18-42)46-29-32-54-50(36-46)49-34-40(26-31-53(49)58-54)39-25-30-52-48(33-39)47-21-10-11-22-51(47)57-52/h1-45H;2*1-39H;1-41H;1-37H;1-36H.
What are the key properties of 1-N-dibenzofuran-4-yl-3-N-dibenzothiophen-3-yl-1-N-phenyl-3-N-[2-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]phenyl]benzene-1,3-diamine;3-N-(8-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenyl-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N-dibenzothiophen-3-yl-1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;3-N-dibenzothiophen-2-yl-1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]benzene-1,3-diamine?
1-N-dibenzofuran-4-yl-3-N-dibenzothiophen-3-yl-1-N-phenyl-3-N-[2-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]phenyl]benzene-1,3-diamine;3-N-(8-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenyl-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N-dibenzothiophen-3-yl-1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;3-N-dibenzothiophen-2-yl-1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]benzene-1,3-diamine has a molecular weight of 5137.64 g/mol, XLogP of 107.82, 50 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-dibenzofuran-4-yl-3-N-dibenzothiophen-3-yl-1-N-phenyl-3-N-[2-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]phenyl]benzene-1,3-diamine;3-N-(8-dibenzothiophen-2-yldibenzothiophen-2-yl)-1-N,1-N-diphenyl-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N-dibenzothiophen-3-yl-1-N,3-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;3-N-dibenzothiophen-2-yl-1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]benzene-1,3-diamine;1-N,1-N-diphenyl-3-N-[8-(9-phenylcarbazol-2-yl)dibenzothiophen-1-yl]-3-N-(4-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N-triphenyl-3-N-[8-(9-phenylcarbazol-3-yl)dibenzothiophen-2-yl]benzene-1,3-diamine is sourced from PubChem (CID 159360188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).