8-dibenzofuran-2-yl-5-[3-(8-dibenzofuran-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-dibenzothiophen-2-yl-5-[3-(8-dibenzothiophen-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-(3-pyridin-3-ylcarbazol-9-yl)-5-[3-[8-(3-pyridin-3-ylcarbazol-9-yl)pyrido[3,2-b]indol-5-yl]-1-benzothiophen-5-yl]pyrido[4,3-b]indole

C172H98N16O2S5 — CID 157441456

IUPAC8-dibenzofuran-2-yl-5-[3-(8-dibenzofuran-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-dibenzothiophen-2-yl-5-[3-(8-dibenzothiophen-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-(3-pyridin-3-ylcarbazol-9-yl)-5-[3-[8-(3-pyridin-3-ylcarbazol-9-yl)pyrido[3,2-b]indol-5-yl]-1-benzothiophen-5-yl]pyrido[4,3-b]indole
SMILESc1ccc2c(c1)oc1ccc(-c3ccc4c(c3)c3cnccc3n4-c3ccc4scc(-n5c6ccncc6c6cc(-c7ccc8oc9ccccc9c8c7)ccc65)c4c3)cc12.c1ccc2c(c1)sc1ccc(-c3ccc4c(c3)c3cnccc3n4-c3ccc4scc(-n5c6ccncc6c6cc(-c7ccc8sc9ccccc9c8c7)ccc65)c4c3)cc12.c1cncc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3c(c2)c2cnccc2n3-c2ccc3scc(-n4c5ccc(-n6c7ccccc7c7cc(-c8cccnc8)ccc76)cc5c5ncccc54)c3c2)c1
InChIInChI=1S/C64H38N8S.C54H30N4O2S.C54H30N4S3/c1-3-12-54-46(10-1)48-30-39(41-8-5-26-65-35-41)15-20-56(48)69(54)43-17-22-58-50(32-43)53-37-67-29-25-60(53)71(58)45-19-24-63-51(33-45)62(38-73-63)72-59-23-18-44(34-52(59)64-61(72)14-7-28-68-64)70-55-13-4-2-11-47(55)49-31-40(16-21-57(49)70)42-9-6-27-66-36-42;1-3-7-50-36(5-1)40-25-33(11-16-52(40)59-50)31-9-14-45-38(23-31)43-28-55-21-19-47(43)57(45)35-13-18-54-42(27-35)49(30-61-54)58-46-15-10-32(24-39(46)44-29-56-22-20-48(44)58)34-12-17-53-41(26-34)37-6-2-4-8-51(37)60-53;1-3-7-51-36(5-1)40-25-33(11-16-53(40)60-51)31-9-14-45-38(23-31)43-28-55-21-19-47(43)57(45)35-13-18-50-42(27-35)49(30-59-50)58-46-15-10-32(24-39(46)44-29-56-22-20-48(44)58)34-12-17-54-41(26-34)37-6-2-4-8-52(37)61-54/h1-38H;2*1-30H
InChIKeyBRSMIUKMOGTXPH-UHFFFAOYSA-N
MW2581.12 g/mol
LogP47.18
Rot. Bonds14

About 8-dibenzofuran-2-yl-5-[3-(8-dibenzofuran-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-dibenzothiophen-2-yl-5-[3-(8-dibenzothiophen-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-(3-pyridin-3-ylcarbazol-9-yl)-5-[3-[8-(3-pyridin-3-ylcarbazol-9-yl)pyrido[3,2-b]indol-5-yl]-1-benzothiophen-5-yl]pyrido[4,3-b]indole

8-dibenzofuran-2-yl-5-[3-(8-dibenzofuran-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-dibenzothiophen-2-yl-5-[3-(8-dibenzothiophen-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-(3-pyridin-3-ylcarbazol-9-yl)-5-[3-[8-(3-pyridin-3-ylcarbazol-9-yl)pyrido[3,2-b]indol-5-yl]-1-benzothiophen-5-yl]pyrido[4,3-b]indole (PubChem CID 157441456) has the molecular formula C172H98N16O2S5 and a molecular weight of 2581.12 g/mol. Its IUPAC name is 8-dibenzofuran-2-yl-5-[3-(8-dibenzofuran-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-dibenzothiophen-2-yl-5-[3-(8-dibenzothiophen-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-(3-pyridin-3-ylcarbazol-9-yl)-5-[3-[8-(3-pyridin-3-ylcarbazol-9-yl)pyrido[3,2-b]indol-5-yl]-1-benzothiophen-5-yl]pyrido[4,3-b]indole.

Molecular Properties

Compound Name8-dibenzofuran-2-yl-5-[3-(8-dibenzofuran-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-dibenzothiophen-2-yl-5-[3-(8-dibenzothiophen-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-(3-pyridin-3-ylcarbazol-9-yl)-5-[3-[8-(3-pyridin-3-ylcarbazol-9-yl)pyrido[3,2-b]indol-5-yl]-1-benzothiophen-5-yl]pyrido[4,3-b]indole
PubChem CID157441456
Molecular FormulaC172H98N16O2S5
Molecular Weight2581.12 g/mol
Exact Mass2578.67
IUPAC Name8-dibenzofuran-2-yl-5-[3-(8-dibenzofuran-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-dibenzothiophen-2-yl-5-[3-(8-dibenzothiophen-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-(3-pyridin-3-ylcarbazol-9-yl)-5-[3-[8-(3-pyridin-3-ylcarbazol-9-yl)pyrido[3,2-b]indol-5-yl]-1-benzothiophen-5-yl]pyrido[4,3-b]indole
SMILESc1ccc2c(c1)oc1ccc(-c3ccc4c(c3)c3cnccc3n4-c3ccc4scc(-n5c6ccncc6c6cc(-c7ccc8oc9ccccc9c8c7)ccc65)c4c3)cc12.c1ccc2c(c1)sc1ccc(-c3ccc4c(c3)c3cnccc3n4-c3ccc4scc(-n5c6ccncc6c6cc(-c7ccc8sc9ccccc9c8c7)ccc65)c4c3)cc12.c1cncc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3c(c2)c2cnccc2n3-c2ccc3scc(-n4c5ccc(-n6c7ccccc7c7cc(-c8cccnc8)ccc76)cc5c5ncccc54)c3c2)c1
InChIInChI=1S/C64H38N8S.C54H30N4O2S.C54H30N4S3/c1-3-12-54-46(10-1)48-30-39(41-8-5-26-65-35-41)15-20-56(48)69(54)43-17-22-58-50(32-43)53-37-67-29-25-60(53)71(58)45-19-24-63-51(33-45)62(38-73-63)72-59-23-18-44(34-52(59)64-61(72)14-7-28-68-64)70-55-13-4-2-11-47(55)49-31-40(16-21-57(49)70)42-9-6-27-66-36-42;1-3-7-50-36(5-1)40-25-33(11-16-52(40)59-50)31-9-14-45-38(23-31)43-28-55-21-19-47(43)57(45)35-13-18-54-42(27-35)49(30-61-54)58-46-15-10-32(24-39(46)44-29-56-22-20-48(44)58)34-12-17-53-41(26-34)37-6-2-4-8-51(37)60-53;1-3-7-51-36(5-1)40-25-33(11-16-53(40)60-51)31-9-14-45-38(23-31)43-28-55-21-19-47(43)57(45)35-13-18-50-42(27-35)49(30-59-50)58-46-15-10-32(24-39(46)44-29-56-22-20-48(44)58)34-12-17-54-41(26-34)37-6-2-4-8-52(37)61-54/h1-38H;2*1-30H
InChIKeyBRSMIUKMOGTXPH-UHFFFAOYSA-N
XLogP47.18
TPSA168.84 Ų
H-Bond Donors
H-Bond Acceptors23
Rotatable Bonds14
Heavy Atoms195
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002581.12
LogP ≤ 547.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1023

Analyze 8-dibenzofuran-2-yl-5-[3-(8-dibenzofuran-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-dibenzothiophen-2-yl-5-[3-(8-dibenzothiophen-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-(3-pyridin-3-ylcarbazol-9-yl)-5-[3-[8-(3-pyridin-3-ylcarbazol-9-yl)pyrido[3,2-b]indol-5-yl]-1-benzothiophen-5-yl]pyrido[4,3-b]indole with MolForge

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Related Compounds

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CID 160627340
4-(1,1-Didecyl-3-hexylsilol-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;9-methyl-3-pentyl-2-[2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-4-pyridinyl]carbazole;4-(2-pentyldibenzofuran-3-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;4-(2-pentyldibenzothiophen-3-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 160768550
9-[8-[3-(3-Dibenzofuran-2-ylphenyl)phenyl]dibenzothiophen-2-yl]pyrido[3,4-b]indole
CID 57544060
8-(3-Dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-5,8,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 57544260
5-[8-[3-(8-Pyrido[3,2-b]indol-5-yldibenzofuran-2-yl)phenyl]dibenzothiophen-2-yl]pyrido[3,2-b]indole
CID 57958322
8-[3-[6-[6-[6-[3-(4,8,12-Triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]dibenzofuran-4-yl]dibenzothiophen-4-yl]dibenzofuran-4-yl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 58059133
3-[3-[3-[8-Dibenzothiophen-2-yl-1-[8-dibenzothiophen-2-yl-4-[3-[3-(9-pyrimidin-5-ylcarbazol-3-yl)phenyl]phenyl]dibenzofuran-1-yl]dibenzofuran-4-yl]phenyl]phenyl]-9-pyrimidin-5-ylcarbazole
CID 58059158
9-Phenyl-3-(2-pyridin-2-ylphenyl)-6-[8-[2-[8-(2-pyridin-2-ylphenyl)dibenzofuran-2-yl]dibenzothiophen-4-yl]dibenzofuran-2-yl]carbazole
CID 58059180
6-Carbazol-9-yl-10-[2-[8-(3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-4-yl]phenyl]-8-thia-4,12-diazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene
CID 58099690
9-[3-(8-Dibenzofuran-2-yldibenzothiophen-2-yl)phenyl]-3,6-dipyridin-2-ylcarbazole
CID 58501544
8-[3-[8-[4,6-Dimethyl-8-[3-(5,8,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]dibenzofuran-2-yl]-4,6-dimethyldibenzothiophen-2-yl]phenyl]-5,8,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 58501587
8-[8-[3-[8-(4,8,12-Triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]phenyl]dibenzothiophen-2-yl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 58511162

Frequently Asked Questions

What is the IUPAC name of 8-dibenzofuran-2-yl-5-[3-(8-dibenzofuran-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-dibenzothiophen-2-yl-5-[3-(8-dibenzothiophen-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-(3-pyridin-3-ylcarbazol-9-yl)-5-[3-[8-(3-pyridin-3-ylcarbazol-9-yl)pyrido[3,2-b]indol-5-yl]-1-benzothiophen-5-yl]pyrido[4,3-b]indole?
The IUPAC name of 8-dibenzofuran-2-yl-5-[3-(8-dibenzofuran-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-dibenzothiophen-2-yl-5-[3-(8-dibenzothiophen-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-(3-pyridin-3-ylcarbazol-9-yl)-5-[3-[8-(3-pyridin-3-ylcarbazol-9-yl)pyrido[3,2-b]indol-5-yl]-1-benzothiophen-5-yl]pyrido[4,3-b]indole (CID 157441456) is 8-dibenzofuran-2-yl-5-[3-(8-dibenzofuran-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-dibenzothiophen-2-yl-5-[3-(8-dibenzothiophen-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-(3-pyridin-3-ylcarbazol-9-yl)-5-[3-[8-(3-pyridin-3-ylcarbazol-9-yl)pyrido[3,2-b]indol-5-yl]-1-benzothiophen-5-yl]pyrido[4,3-b]indole.
What is the SMILES notation for 8-dibenzofuran-2-yl-5-[3-(8-dibenzofuran-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-dibenzothiophen-2-yl-5-[3-(8-dibenzothiophen-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-(3-pyridin-3-ylcarbazol-9-yl)-5-[3-[8-(3-pyridin-3-ylcarbazol-9-yl)pyrido[3,2-b]indol-5-yl]-1-benzothiophen-5-yl]pyrido[4,3-b]indole?
The canonical SMILES for 8-dibenzofuran-2-yl-5-[3-(8-dibenzofuran-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-dibenzothiophen-2-yl-5-[3-(8-dibenzothiophen-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-(3-pyridin-3-ylcarbazol-9-yl)-5-[3-[8-(3-pyridin-3-ylcarbazol-9-yl)pyrido[3,2-b]indol-5-yl]-1-benzothiophen-5-yl]pyrido[4,3-b]indole is c1ccc2c(c1)oc1ccc(-c3ccc4c(c3)c3cnccc3n4-c3ccc4scc(-n5c6ccncc6c6cc(-c7ccc8oc9ccccc9c8c7)ccc65)c4c3)cc12.c1ccc2c(c1)sc1ccc(-c3ccc4c(c3)c3cnccc3n4-c3ccc4scc(-n5c6ccncc6c6cc(-c7ccc8sc9ccccc9c8c7)ccc65)c4c3)cc12.c1cncc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3c(c2)c2cnccc2n3-c2ccc3scc(-n4c5ccc(-n6c7ccccc7c7cc(-c8cccnc8)ccc76)cc5c5ncccc54)c3c2)c1.
What is the InChIKey of 8-dibenzofuran-2-yl-5-[3-(8-dibenzofuran-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-dibenzothiophen-2-yl-5-[3-(8-dibenzothiophen-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-(3-pyridin-3-ylcarbazol-9-yl)-5-[3-[8-(3-pyridin-3-ylcarbazol-9-yl)pyrido[3,2-b]indol-5-yl]-1-benzothiophen-5-yl]pyrido[4,3-b]indole?
The InChIKey is BRSMIUKMOGTXPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H38N8S.C54H30N4O2S.C54H30N4S3/c1-3-12-54-46(10-1)48-30-39(41-8-5-26-65-35-41)15-20-56(48)69(54)43-17-22-58-50(32-43)53-37-67-29-25-60(53)71(58)45-19-24-63-51(33-45)62(38-73-63)72-59-23-18-44(34-52(59)64-61(72)14-7-28-68-64)70-55-13-4-2-11-47(55)49-31-40(16-21-57(49)70)42-9-6-27-66-36-42;1-3-7-50-36(5-1)40-25-33(11-16-52(40)59-50)31-9-14-45-38(23-31)43-28-55-21-19-47(43)57(45)35-13-18-54-42(27-35)49(30-61-54)58-46-15-10-32(24-39(46)44-29-56-22-20-48(44)58)34-12-17-53-41(26-34)37-6-2-4-8-51(37)60-53;1-3-7-51-36(5-1)40-25-33(11-16-53(40)60-51)31-9-14-45-38(23-31)43-28-55-21-19-47(43)57(45)35-13-18-50-42(27-35)49(30-59-50)58-46-15-10-32(24-39(46)44-29-56-22-20-48(44)58)34-12-17-54-41(26-34)37-6-2-4-8-52(37)61-54/h1-38H;2*1-30H.
What are the key properties of 8-dibenzofuran-2-yl-5-[3-(8-dibenzofuran-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-dibenzothiophen-2-yl-5-[3-(8-dibenzothiophen-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-(3-pyridin-3-ylcarbazol-9-yl)-5-[3-[8-(3-pyridin-3-ylcarbazol-9-yl)pyrido[3,2-b]indol-5-yl]-1-benzothiophen-5-yl]pyrido[4,3-b]indole?
8-dibenzofuran-2-yl-5-[3-(8-dibenzofuran-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-dibenzothiophen-2-yl-5-[3-(8-dibenzothiophen-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-(3-pyridin-3-ylcarbazol-9-yl)-5-[3-[8-(3-pyridin-3-ylcarbazol-9-yl)pyrido[3,2-b]indol-5-yl]-1-benzothiophen-5-yl]pyrido[4,3-b]indole has a molecular weight of 2581.12 g/mol, XLogP of 47.18, 14 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 8-dibenzofuran-2-yl-5-[3-(8-dibenzofuran-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-dibenzothiophen-2-yl-5-[3-(8-dibenzothiophen-2-ylpyrido[4,3-b]indol-5-yl)-1-benzothiophen-5-yl]pyrido[4,3-b]indole;8-(3-pyridin-3-ylcarbazol-9-yl)-5-[3-[8-(3-pyridin-3-ylcarbazol-9-yl)pyrido[3,2-b]indol-5-yl]-1-benzothiophen-5-yl]pyrido[4,3-b]indole is sourced from PubChem (CID 157441456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).