3-[2-(2-carbazol-9-yldibenzothiophen-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole;9-[[4-[6-(2-cyclohexylimidazol-1-yl)-2,8-di(propan-2-yl)dibenzofuran-4-yl]benzimidazol-1-yl]methoxymethyl]carbazole;9-dibenzothiophen-4-yl-3,6-bis(2-pyridin-2-ylphenyl)carbazole

C148H108N10O3S2 — CID 158757144

IUPAC3-[2-(2-carbazol-9-yldibenzothiophen-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole;9-[[4-[6-(2-cyclohexylimidazol-1-yl)-2,8-di(propan-2-yl)dibenzofuran-4-yl]benzimidazol-1-yl]methoxymethyl]carbazole;9-dibenzothiophen-4-yl-3,6-bis(2-pyridin-2-ylphenyl)carbazole
SMILESCC(C)c1cc(-c2cccc3c2ncn3COCn2c3ccccc3c3ccccc32)c2oc3c(-n4ccnc4C4CCCCC4)cc(C(C)C)cc3c2c1.c1ccc(-c2ccccc2-c2ccc3c(c2)c2cc(-c4ccccc4-c4ccccn4)ccc2n3-c2cccc3c2sc2ccccc23)nc1.c1ccc(-n2c3ccccc3c3cc(-c4cc(-c5cc(-n6c7ccccc7c7ccccc76)cc6c5sc5ccccc56)cc5c4oc4ccccc45)ccc32)cc1
InChIInChI=1S/C54H32N2OS.C48H47N5O2.C46H29N3S/c1-2-14-35(15-3-1)55-49-23-11-6-18-39(49)44-28-33(26-27-50(44)55)42-29-34(30-45-40-19-7-12-24-51(40)57-53(42)45)43-31-36(32-46-41-20-8-13-25-52(41)58-54(43)46)56-47-21-9-4-16-37(47)38-17-5-10-22-48(38)56;1-30(2)33-23-38(46-39(24-33)40-25-34(31(3)4)26-44(47(40)55-46)52-22-21-49-48(52)32-13-6-5-7-14-32)37-17-12-20-43-45(37)50-27-51(43)28-54-29-53-41-18-10-8-15-35(41)36-16-9-11-19-42(36)53;1-3-14-34(40-18-7-9-26-47-40)32(12-1)30-22-24-42-38(28-30)39-29-31(33-13-2-4-15-35(33)41-19-8-10-27-48-41)23-25-43(39)49(42)44-20-11-17-37-36-16-5-6-21-45(36)50-46(37)44/h1-32H;8-12,15-27,30-32H,5-7,13-14,28-29H2,1-4H3;1-29H
InChIKeyIOFDGLYJYKNXSQ-UHFFFAOYSA-N
MW2138.69 g/mol
LogP40.91
Rot. Bonds18

About 3-[2-(2-carbazol-9-yldibenzothiophen-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole;9-[[4-[6-(2-cyclohexylimidazol-1-yl)-2,8-di(propan-2-yl)dibenzofuran-4-yl]benzimidazol-1-yl]methoxymethyl]carbazole;9-dibenzothiophen-4-yl-3,6-bis(2-pyridin-2-ylphenyl)carbazole

3-[2-(2-carbazol-9-yldibenzothiophen-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole;9-[[4-[6-(2-cyclohexylimidazol-1-yl)-2,8-di(propan-2-yl)dibenzofuran-4-yl]benzimidazol-1-yl]methoxymethyl]carbazole;9-dibenzothiophen-4-yl-3,6-bis(2-pyridin-2-ylphenyl)carbazole (PubChem CID 158757144) has the molecular formula C148H108N10O3S2 and a molecular weight of 2138.69 g/mol. Its IUPAC name is 3-[2-(2-carbazol-9-yldibenzothiophen-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole;9-[[4-[6-(2-cyclohexylimidazol-1-yl)-2,8-di(propan-2-yl)dibenzofuran-4-yl]benzimidazol-1-yl]methoxymethyl]carbazole;9-dibenzothiophen-4-yl-3,6-bis(2-pyridin-2-ylphenyl)carbazole.

Molecular Properties

Compound Name3-[2-(2-carbazol-9-yldibenzothiophen-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole;9-[[4-[6-(2-cyclohexylimidazol-1-yl)-2,8-di(propan-2-yl)dibenzofuran-4-yl]benzimidazol-1-yl]methoxymethyl]carbazole;9-dibenzothiophen-4-yl-3,6-bis(2-pyridin-2-ylphenyl)carbazole
PubChem CID158757144
Molecular FormulaC148H108N10O3S2
Molecular Weight2138.69 g/mol
Exact Mass2136.80
IUPAC Name3-[2-(2-carbazol-9-yldibenzothiophen-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole;9-[[4-[6-(2-cyclohexylimidazol-1-yl)-2,8-di(propan-2-yl)dibenzofuran-4-yl]benzimidazol-1-yl]methoxymethyl]carbazole;9-dibenzothiophen-4-yl-3,6-bis(2-pyridin-2-ylphenyl)carbazole
SMILESCC(C)c1cc(-c2cccc3c2ncn3COCn2c3ccccc3c3ccccc32)c2oc3c(-n4ccnc4C4CCCCC4)cc(C(C)C)cc3c2c1.c1ccc(-c2ccccc2-c2ccc3c(c2)c2cc(-c4ccccc4-c4ccccn4)ccc2n3-c2cccc3c2sc2ccccc23)nc1.c1ccc(-n2c3ccccc3c3cc(-c4cc(-c5cc(-n6c7ccccc7c7ccccc76)cc6c5sc5ccccc56)cc5c4oc4ccccc45)ccc32)cc1
InChIInChI=1S/C54H32N2OS.C48H47N5O2.C46H29N3S/c1-2-14-35(15-3-1)55-49-23-11-6-18-39(49)44-28-33(26-27-50(44)55)42-29-34(30-45-40-19-7-12-24-51(40)57-53(42)45)43-31-36(32-46-41-20-8-13-25-52(41)58-54(43)46)56-47-21-9-4-16-37(47)38-17-5-10-22-48(38)56;1-30(2)33-23-38(46-39(24-33)40-25-34(31(3)4)26-44(47(40)55-46)52-22-21-49-48(52)32-13-6-5-7-14-32)37-17-12-20-43-45(37)50-27-51(43)28-54-29-53-41-18-10-8-15-35(41)36-16-9-11-19-42(36)53;1-3-14-34(40-18-7-9-26-47-40)32(12-1)30-22-24-42-38(28-30)39-29-31(33-13-2-4-15-35(33)41-19-8-10-27-48-41)23-25-43(39)49(42)44-20-11-17-37-36-16-5-6-21-45(36)50-46(37)44/h1-32H;8-12,15-27,30-32H,5-7,13-14,28-29H2,1-4H3;1-29H
InChIKeyIOFDGLYJYKNXSQ-UHFFFAOYSA-N
XLogP40.91
TPSA116.65 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds18
Heavy Atoms163
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002138.69
LogP ≤ 540.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 3-[2-(2-carbazol-9-yldibenzothiophen-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole;9-[[4-[6-(2-cyclohexylimidazol-1-yl)-2,8-di(propan-2-yl)dibenzofuran-4-yl]benzimidazol-1-yl]methoxymethyl]carbazole;9-dibenzothiophen-4-yl-3,6-bis(2-pyridin-2-ylphenyl)carbazole with MolForge

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Related Compounds

1-(4-tert-butyl-2,6-diphenylphenyl)-2-[7-(4-fluorophenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;[4-[cyclohexyl(dideuterio)methyl]-6-phenyl-3-pyridinyl]-trimethylsilane;tris([4-(2-deuteriopropan-2-yl)-6-phenyl-3-pyridinyl]-trimethylsilane);4-[4-(1-dibenzofuran-4-ylbenzimidazol-2-yl)-3H-dibenzofuran-3-id-1-yl]benzonitrile;1-dibenzothiophen-2-yl-2-[8-(3,5-difluorophenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;(4,5-dimethyl-6-phenyl-3-pyridinyl)-trimethylsilane;1-(2,6-diphenylphenyl)-2-[7-(4-fluorophenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;1-(2,4-diphenylphenyl)-2-[7-(2-fluorophenyl)-1-phenyl-3H-dibenzofuran-3-id-4-yl]benzimidazole;1-(2,5-diphenylphenyl)-7-fluoro-2-[8-[4-(trifluoromethyl)phenyl]-3H-dibenzofuran-3-id-4-yl]benzimidazole;hexakis(iridium);trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane
CID 157396367
6-Dibenzothiophen-2-yl-3-isocyano-1,9-diphenylcarbazole;3,9-di(dibenzofuran-2-yl)-6-isocyanocarbazole;3-isocyano-6-(1-phenylbenzimidazol-4-yl)-9-[5-[6-(trifluoromethyl)dibenzothiophen-2-yl]-3-pyridinyl]carbazole
CID 160492128
2,5-Bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-methyl-6-(trifluoromethyl)phenyl]benzonitrile;2,5-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[2-methyl-6-(trifluoromethyl)phenyl]benzonitrile;2,5-bis([1]benzothiolo[2,3-a]carbazol-12-yl)-4-[2-methyl-6-(trifluoromethyl)phenyl]benzonitrile;2,5-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[2-methyl-6-(trifluoromethyl)phenyl]benzonitrile;2-(5-methylindolo[3,2-c]carbazol-12-yl)-4-[2-methyl-6-(trifluoromethyl)phenyl]-5-(5-phenylindolo[3,2-c]carbazol-12-yl)benzonitrile;4-[2-methyl-6-(trifluoromethyl)phenyl]-2,5-bis(11-phenylindolo[2,3-a]carbazol-12-yl)benzonitrile;4-[2-methyl-6-(trifluoromethyl)phenyl]-2,5-bis(2-pyrimidin-2-ylcarbazol-9-yl)benzonitrile;4-[2-methyl-6-(trifluoromethyl)phenyl]-2,5-bis(3-pyrimidin-2-ylcarbazol-9-yl)benzonitrile
CID 160830901
12-Dibenzothiophen-4-yl-23-thia-10-azahexacyclo[12.11.0.02,11.03,8.016,24.017,22]pentacosa-1(25),2(11),3,5,7,9,12,14,16(24),17,19,21-dodecaene;20-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-18-methyl-10-oxa-15-azapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene;17-methyl-20-(9-phenylcarbazol-3-yl)-10-thia-15,18-diazapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene;15-methyl-20-[9-[4-(trifluoromethyl)phenyl]carbazol-3-yl]-10-thia-18-azapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene
CID 161901264
9-[8-[4,6-Di(propan-2-yl)-8-[3-pyridin-2-yl-6-(3-pyrimidin-2-ylphenyl)carbazol-9-yl]dibenzofuran-2-yl]-4,6-di(propan-2-yl)dibenzothiophen-2-yl]-3-pyridin-2-yl-6-(3-pyrimidin-2-ylphenyl)carbazole
CID 57958351
2-[2-[3,6-Bis[3-(1-methyl-5-phenylimidazol-2-yl)phenyl]carbazol-9-yl]-6,8-bis(5-phenyl-1,3-thiazol-2-yl)dibenzofuran-4-yl]-5-phenyl-1,3-thiazole
CID 57958355
Iridium;2-phenyl-1-(2,4,6-trimethylphenyl)imidazole;8-[2-[5-[3-[5-[4-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]benzene-5-id-1-yl]hexan-3-yl]phenyl]pyrido[3,2-b]indol-8-yl]dibenzofuran-4-yl]-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 58059020
2-Phenyl-1-[8-[6-(2-phenylimidazol-1-yl)dibenzofuran-2-yl]dibenzothiophen-2-yl]imidazole
CID 58059095
9-[[4-[6-(2-Cyclohexylimidazol-1-yl)-2,8-di(propan-2-yl)dibenzofuran-4-yl]benzimidazol-1-yl]methoxymethyl]carbazole
CID 58059136
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
5-Phenyl-8-[6-[9-[6-(5,8,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)dibenzofuran-2-yl]pyrimido[4,5-b]indol-6-yl]dibenzofuran-2-yl]pyrimido[5,4-b]indole
CID 58099847
1-[3-(9-Dibenzofuran-4-ylcarbazol-3-yl)carbazol-9-yl]-[1]benzothiolo[2,3-c]pyridine
CID 58479584

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-carbazol-9-yldibenzothiophen-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole;9-[[4-[6-(2-cyclohexylimidazol-1-yl)-2,8-di(propan-2-yl)dibenzofuran-4-yl]benzimidazol-1-yl]methoxymethyl]carbazole;9-dibenzothiophen-4-yl-3,6-bis(2-pyridin-2-ylphenyl)carbazole?
The IUPAC name of 3-[2-(2-carbazol-9-yldibenzothiophen-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole;9-[[4-[6-(2-cyclohexylimidazol-1-yl)-2,8-di(propan-2-yl)dibenzofuran-4-yl]benzimidazol-1-yl]methoxymethyl]carbazole;9-dibenzothiophen-4-yl-3,6-bis(2-pyridin-2-ylphenyl)carbazole (CID 158757144) is 3-[2-(2-carbazol-9-yldibenzothiophen-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole;9-[[4-[6-(2-cyclohexylimidazol-1-yl)-2,8-di(propan-2-yl)dibenzofuran-4-yl]benzimidazol-1-yl]methoxymethyl]carbazole;9-dibenzothiophen-4-yl-3,6-bis(2-pyridin-2-ylphenyl)carbazole.
What is the SMILES notation for 3-[2-(2-carbazol-9-yldibenzothiophen-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole;9-[[4-[6-(2-cyclohexylimidazol-1-yl)-2,8-di(propan-2-yl)dibenzofuran-4-yl]benzimidazol-1-yl]methoxymethyl]carbazole;9-dibenzothiophen-4-yl-3,6-bis(2-pyridin-2-ylphenyl)carbazole?
The canonical SMILES for 3-[2-(2-carbazol-9-yldibenzothiophen-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole;9-[[4-[6-(2-cyclohexylimidazol-1-yl)-2,8-di(propan-2-yl)dibenzofuran-4-yl]benzimidazol-1-yl]methoxymethyl]carbazole;9-dibenzothiophen-4-yl-3,6-bis(2-pyridin-2-ylphenyl)carbazole is CC(C)c1cc(-c2cccc3c2ncn3COCn2c3ccccc3c3ccccc32)c2oc3c(-n4ccnc4C4CCCCC4)cc(C(C)C)cc3c2c1.c1ccc(-c2ccccc2-c2ccc3c(c2)c2cc(-c4ccccc4-c4ccccn4)ccc2n3-c2cccc3c2sc2ccccc23)nc1.c1ccc(-n2c3ccccc3c3cc(-c4cc(-c5cc(-n6c7ccccc7c7ccccc76)cc6c5sc5ccccc56)cc5c4oc4ccccc45)ccc32)cc1.
What is the InChIKey of 3-[2-(2-carbazol-9-yldibenzothiophen-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole;9-[[4-[6-(2-cyclohexylimidazol-1-yl)-2,8-di(propan-2-yl)dibenzofuran-4-yl]benzimidazol-1-yl]methoxymethyl]carbazole;9-dibenzothiophen-4-yl-3,6-bis(2-pyridin-2-ylphenyl)carbazole?
The InChIKey is IOFDGLYJYKNXSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H32N2OS.C48H47N5O2.C46H29N3S/c1-2-14-35(15-3-1)55-49-23-11-6-18-39(49)44-28-33(26-27-50(44)55)42-29-34(30-45-40-19-7-12-24-51(40)57-53(42)45)43-31-36(32-46-41-20-8-13-25-52(41)58-54(43)46)56-47-21-9-4-16-37(47)38-17-5-10-22-48(38)56;1-30(2)33-23-38(46-39(24-33)40-25-34(31(3)4)26-44(47(40)55-46)52-22-21-49-48(52)32-13-6-5-7-14-32)37-17-12-20-43-45(37)50-27-51(43)28-54-29-53-41-18-10-8-15-35(41)36-16-9-11-19-42(36)53;1-3-14-34(40-18-7-9-26-47-40)32(12-1)30-22-24-42-38(28-30)39-29-31(33-13-2-4-15-35(33)41-19-8-10-27-48-41)23-25-43(39)49(42)44-20-11-17-37-36-16-5-6-21-45(36)50-46(37)44/h1-32H;8-12,15-27,30-32H,5-7,13-14,28-29H2,1-4H3;1-29H.
What are the key properties of 3-[2-(2-carbazol-9-yldibenzothiophen-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole;9-[[4-[6-(2-cyclohexylimidazol-1-yl)-2,8-di(propan-2-yl)dibenzofuran-4-yl]benzimidazol-1-yl]methoxymethyl]carbazole;9-dibenzothiophen-4-yl-3,6-bis(2-pyridin-2-ylphenyl)carbazole?
3-[2-(2-carbazol-9-yldibenzothiophen-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole;9-[[4-[6-(2-cyclohexylimidazol-1-yl)-2,8-di(propan-2-yl)dibenzofuran-4-yl]benzimidazol-1-yl]methoxymethyl]carbazole;9-dibenzothiophen-4-yl-3,6-bis(2-pyridin-2-ylphenyl)carbazole has a molecular weight of 2138.69 g/mol, XLogP of 40.91, 18 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-carbazol-9-yldibenzothiophen-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole;9-[[4-[6-(2-cyclohexylimidazol-1-yl)-2,8-di(propan-2-yl)dibenzofuran-4-yl]benzimidazol-1-yl]methoxymethyl]carbazole;9-dibenzothiophen-4-yl-3,6-bis(2-pyridin-2-ylphenyl)carbazole is sourced from PubChem (CID 158757144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).