11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole

C171H99N15OS5 — CID 160601461

IUPAC11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4oc5ccc(-n6c7ccccc7c7cc(-n8c9ccccc9c9cc%10sc%11ccccc%11c%10cc98)ccc76)cc5c4c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4sc5ccc(-n6c7ccccc7c7cc(-n8c9ccccc9c9cc%10sc%11ccccc%11c%10cc98)ccc76)cc5c4c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3sc3c(-n5c6ccccc6c6cc(-n7c8ccccc8c8cc9sc%10ccccc%10c9cc87)ccc65)cccc34)n2)cc1
InChIInChI=1S/C57H33N5OS.2C57H33N5S2/c1-3-13-34(14-4-1)55-58-56(35-15-5-2-6-16-35)60-57(59-55)36-23-27-51-44(29-36)45-31-38(25-28-52(45)63-51)61-47-20-10-7-17-39(47)42-30-37(24-26-49(42)61)62-48-21-11-8-18-40(48)43-33-54-46(32-50(43)62)41-19-9-12-22-53(41)64-54;1-3-15-34(16-4-1)55-58-56(35-17-5-2-6-18-35)60-57(59-55)42-24-13-22-40-41-23-14-27-49(54(41)64-53(40)42)62-47-26-11-8-19-37(47)43-31-36(29-30-48(43)62)61-46-25-10-7-20-38(46)44-33-52-45(32-50(44)61)39-21-9-12-28-51(39)63-52;1-3-13-34(14-4-1)55-58-56(35-15-5-2-6-16-35)60-57(59-55)36-23-27-52-44(29-36)45-31-38(25-28-53(45)63-52)61-47-20-10-7-17-39(47)42-30-37(24-26-49(42)61)62-48-21-11-8-18-40(48)43-33-54-46(32-50(43)62)41-19-9-12-22-51(41)64-54/h3*1-33H
InChIKeyREIHAEVVKJNIEX-UHFFFAOYSA-N
MW2540.11 g/mol
LogP46.94
Rot. Bonds15

About 11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole

11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole (PubChem CID 160601461) has the molecular formula C171H99N15OS5 and a molecular weight of 2540.11 g/mol. Its IUPAC name is 11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole.

Molecular Properties

Compound Name11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole
PubChem CID160601461
Molecular FormulaC171H99N15OS5
Molecular Weight2540.11 g/mol
Exact Mass2537.68
IUPAC Name11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4oc5ccc(-n6c7ccccc7c7cc(-n8c9ccccc9c9cc%10sc%11ccccc%11c%10cc98)ccc76)cc5c4c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4sc5ccc(-n6c7ccccc7c7cc(-n8c9ccccc9c9cc%10sc%11ccccc%11c%10cc98)ccc76)cc5c4c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3sc3c(-n5c6ccccc6c6cc(-n7c8ccccc8c8cc9sc%10ccccc%10c9cc87)ccc65)cccc34)n2)cc1
InChIInChI=1S/C57H33N5OS.2C57H33N5S2/c1-3-13-34(14-4-1)55-58-56(35-15-5-2-6-16-35)60-57(59-55)36-23-27-51-44(29-36)45-31-38(25-28-52(45)63-51)61-47-20-10-7-17-39(47)42-30-37(24-26-49(42)61)62-48-21-11-8-18-40(48)43-33-54-46(32-50(43)62)41-19-9-12-22-53(41)64-54;1-3-15-34(16-4-1)55-58-56(35-17-5-2-6-18-35)60-57(59-55)42-24-13-22-40-41-23-14-27-49(54(41)64-53(40)42)62-47-26-11-8-19-37(47)43-31-36(29-30-48(43)62)61-46-25-10-7-20-38(46)44-33-52-45(32-50(44)61)39-21-9-12-28-51(39)63-52;1-3-13-34(14-4-1)55-58-56(35-15-5-2-6-16-35)60-57(59-55)36-23-27-52-44(29-36)45-31-38(25-28-53(45)63-52)61-47-20-10-7-17-39(47)42-30-37(24-26-49(42)61)62-48-21-11-8-18-40(48)43-33-54-46(32-50(43)62)41-19-9-12-22-51(41)64-54/h3*1-33H
InChIKeyREIHAEVVKJNIEX-UHFFFAOYSA-N
XLogP46.94
TPSA158.73 Ų
H-Bond Donors
H-Bond Acceptors21
Rotatable Bonds15
Heavy Atoms192
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002540.11
LogP ≤ 546.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1021

Analyze 11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole with MolForge

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Related Compounds

3-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazol-3-yl]-9-(9-phenylcarbazol-3-yl)carbazole;3-[9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]carbazol-3-yl]-9-(9-phenylcarbazol-3-yl)carbazole
CID 161473912
3-(10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaen-6-yl)-9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazole;3-(10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaen-6-yl)-9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]carbazole
CID 159600279
3-[9-[6-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzothiophen-2-yl]carbazol-3-yl]-9-phenylcarbazole
CID 158820483
9-dibenzothiophen-2-yl-3-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-6-phenylcarbazole
CID 118020018
3,6-di(carbazol-9-yl)-9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]carbazole
CID 90211412
9-[8-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]carbazole
CID 166953128
4-[4-[4-[8-[3-([1]benzothiolo[2,3-a]carbazol-12-yl)carbazol-9-yl]dibenzothiophen-2-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-11-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole
CID 138622688
9-[9-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-3-phenylcarbazole
CID 176725762
3-carbazol-9-yl-9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazole;3-carbazol-9-yl-9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazole;3,6-di(carbazol-9-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 159267968
9-[6-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]dibenzofuran-2-yl]carbazole
CID 169011262
3-(4-dibenzofuran-2-yl-6-dibenzothiophen-4-yl-1,3,5-triazin-2-yl)-9-phenylcarbazole
CID 170135119
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;3-(9-dibenzothiophen-2-ylcarbazol-3-yl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole
CID 158229198

Frequently Asked Questions

What is the IUPAC name of 11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole?
The IUPAC name of 11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole (CID 160601461) is 11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole.
What is the SMILES notation for 11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole?
The canonical SMILES for 11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole is c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4oc5ccc(-n6c7ccccc7c7cc(-n8c9ccccc9c9cc%10sc%11ccccc%11c%10cc98)ccc76)cc5c4c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4sc5ccc(-n6c7ccccc7c7cc(-n8c9ccccc9c9cc%10sc%11ccccc%11c%10cc98)ccc76)cc5c4c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3sc3c(-n5c6ccccc6c6cc(-n7c8ccccc8c8cc9sc%10ccccc%10c9cc87)ccc65)cccc34)n2)cc1.
What is the InChIKey of 11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole?
The InChIKey is REIHAEVVKJNIEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H33N5OS.2C57H33N5S2/c1-3-13-34(14-4-1)55-58-56(35-15-5-2-6-16-35)60-57(59-55)36-23-27-51-44(29-36)45-31-38(25-28-52(45)63-51)61-47-20-10-7-17-39(47)42-30-37(24-26-49(42)61)62-48-21-11-8-18-40(48)43-33-54-46(32-50(43)62)41-19-9-12-22-53(41)64-54;1-3-15-34(16-4-1)55-58-56(35-17-5-2-6-18-35)60-57(59-55)42-24-13-22-40-41-23-14-27-49(54(41)64-53(40)42)62-47-26-11-8-19-37(47)43-31-36(29-30-48(43)62)61-46-25-10-7-20-38(46)44-33-52-45(32-50(44)61)39-21-9-12-28-51(39)63-52;1-3-13-34(14-4-1)55-58-56(35-15-5-2-6-16-35)60-57(59-55)36-23-27-52-44(29-36)45-31-38(25-28-53(45)63-52)61-47-20-10-7-17-39(47)42-30-37(24-26-49(42)61)62-48-21-11-8-18-40(48)43-33-54-46(32-50(43)62)41-19-9-12-22-51(41)64-54/h3*1-33H.
What are the key properties of 11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole?
11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole has a molecular weight of 2540.11 g/mol, XLogP of 46.94, 15 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole;11-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazol-3-yl]-[1]benzothiolo[3,2-b]carbazole is sourced from PubChem (CID 160601461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).