2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzofuran-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzothiophen-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;9-[3-[4-[4-(1-benzofuran-2-yl)phenyl]-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazin-2-yl]-5-carbazol-9-ylphenyl]carbazole

C153H93N11O4S — CID 157242372

IUPAC2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzofuran-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzothiophen-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;9-[3-[4-[4-(1-benzofuran-2-yl)phenyl]-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazin-2-yl]-5-carbazol-9-ylphenyl]carbazole
SMILESc1ccc2oc(-c3ccc(-c4nc(-c5ccc(-c6cccc7ccccc67)cc5)nc(-c5cc(-n6c7ccccc7c7ccccc76)cc(-n6c7ccccc7c7ccccc76)c5)n4)cc3)cc2c1.c1ccc2oc(-c3ccc(-c4nc(-c5ccc(-c6cccc7ccccc67)cc5)nc(-c5ccc6c(c5)oc5ccccc56)n4)cc3)cc2c1.c1ccc2oc(-c3ccc(-c4nc(-c5ccc(-c6cccc7ccccc67)cc5)nc(-c5ccc6c(c5)sc5ccccc56)n4)cc3)cc2c1
InChIInChI=1S/C63H39N5O.C45H27N3O2.C45H27N3OS/c1-3-17-49-40(14-1)16-13-22-50(49)41-28-32-43(33-29-41)61-64-62(44-34-30-42(31-35-44)60-38-45-15-2-12-27-59(45)69-60)66-63(65-61)46-36-47(67-55-23-8-4-18-51(55)52-19-5-9-24-56(52)67)39-48(37-46)68-57-25-10-6-20-53(57)54-21-7-11-26-58(54)68;1-3-11-35-28(8-1)10-7-13-36(35)29-16-20-31(21-17-29)43-46-44(32-22-18-30(19-23-32)41-26-33-9-2-5-14-39(33)49-41)48-45(47-43)34-24-25-38-37-12-4-6-15-40(37)50-42(38)27-34;1-3-11-35-28(8-1)10-7-13-36(35)29-16-20-31(21-17-29)43-46-44(32-22-18-30(19-23-32)40-26-33-9-2-5-14-39(33)49-40)48-45(47-43)34-24-25-38-37-12-4-6-15-41(37)50-42(38)27-34/h1-39H;2*1-27H
InChIKeyAVIYUPXSJMGQNJ-UHFFFAOYSA-N
MW2181.57 g/mol
LogP40.78
Rot. Bonds17

About 2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzofuran-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzothiophen-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;9-[3-[4-[4-(1-benzofuran-2-yl)phenyl]-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazin-2-yl]-5-carbazol-9-ylphenyl]carbazole

2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzofuran-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzothiophen-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;9-[3-[4-[4-(1-benzofuran-2-yl)phenyl]-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazin-2-yl]-5-carbazol-9-ylphenyl]carbazole (PubChem CID 157242372) has the molecular formula C153H93N11O4S and a molecular weight of 2181.57 g/mol. Its IUPAC name is 2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzofuran-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzothiophen-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;9-[3-[4-[4-(1-benzofuran-2-yl)phenyl]-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazin-2-yl]-5-carbazol-9-ylphenyl]carbazole.

Molecular Properties

Compound Name2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzofuran-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzothiophen-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;9-[3-[4-[4-(1-benzofuran-2-yl)phenyl]-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazin-2-yl]-5-carbazol-9-ylphenyl]carbazole
PubChem CID157242372
Molecular FormulaC153H93N11O4S
Molecular Weight2181.57 g/mol
Exact Mass2179.71
IUPAC Name2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzofuran-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzothiophen-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;9-[3-[4-[4-(1-benzofuran-2-yl)phenyl]-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazin-2-yl]-5-carbazol-9-ylphenyl]carbazole
SMILESc1ccc2oc(-c3ccc(-c4nc(-c5ccc(-c6cccc7ccccc67)cc5)nc(-c5cc(-n6c7ccccc7c7ccccc76)cc(-n6c7ccccc7c7ccccc76)c5)n4)cc3)cc2c1.c1ccc2oc(-c3ccc(-c4nc(-c5ccc(-c6cccc7ccccc67)cc5)nc(-c5ccc6c(c5)oc5ccccc56)n4)cc3)cc2c1.c1ccc2oc(-c3ccc(-c4nc(-c5ccc(-c6cccc7ccccc67)cc5)nc(-c5ccc6c(c5)sc5ccccc56)n4)cc3)cc2c1
InChIInChI=1S/C63H39N5O.C45H27N3O2.C45H27N3OS/c1-3-17-49-40(14-1)16-13-22-50(49)41-28-32-43(33-29-41)61-64-62(44-34-30-42(31-35-44)60-38-45-15-2-12-27-59(45)69-60)66-63(65-61)46-36-47(67-55-23-8-4-18-51(55)52-19-5-9-24-56(52)67)39-48(37-46)68-57-25-10-6-20-53(57)54-21-7-11-26-58(54)68;1-3-11-35-28(8-1)10-7-13-36(35)29-16-20-31(21-17-29)43-46-44(32-22-18-30(19-23-32)41-26-33-9-2-5-14-39(33)49-41)48-45(47-43)34-24-25-38-37-12-4-6-15-40(37)50-42(38)27-34;1-3-11-35-28(8-1)10-7-13-36(35)29-16-20-31(21-17-29)43-46-44(32-22-18-30(19-23-32)40-26-33-9-2-5-14-39(33)49-40)48-45(47-43)34-24-25-38-37-12-4-6-15-41(37)50-42(38)27-34/h1-39H;2*1-27H
InChIKeyAVIYUPXSJMGQNJ-UHFFFAOYSA-N
XLogP40.78
TPSA178.43 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds17
Heavy Atoms169
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002181.57
LogP ≤ 540.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze 2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzofuran-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzothiophen-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;9-[3-[4-[4-(1-benzofuran-2-yl)phenyl]-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazin-2-yl]-5-carbazol-9-ylphenyl]carbazole with MolForge

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Related Compounds

9-[3-(4-dibenzofuran-3-yl-6-dibenzothiophen-3-yl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 176831517
9-[4-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-2-phenylcarbazole;9-[4-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-2-phenylcarbazole;2-phenyl-9-[4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 165082275
3-[4-(1-benzofuran-2-yl)-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole
CID 146183239
7-[4-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)-2,6-diphenylphenyl]-[1]benzothiolo[2,3-b]carbazole
CID 146280819
5-[4-[4,6-di(dibenzothiophen-3-yl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]benzo[b]carbazole
CID 167347924
2-[7-[9-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-3-yl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 168767810
4-[7-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-yl]-9-phenylcarbazole
CID 158491258
2-dibenzofuran-1-yl-4,6-diphenyl-1,3,5-triazine;2-dibenzofuran-3-yl-4,6-diphenyl-1,3,5-triazine;3-dibenzofuran-1-yl-9-phenylcarbazole;2-dibenzothiophen-1-yl-4,6-diphenyl-1,3,5-triazine;2-dibenzothiophen-3-yl-4,6-diphenyl-1,3,5-triazine
CID 163752902
9-[3-[4-(8-dibenzothiophen-2-yldibenzofuran-3-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole
CID 162780092
9-[4-(7-dibenzothiophen-3-yldibenzofuran-1-yl)-6-phenyl-1,3,5-triazin-2-yl]carbazole
CID 166952562
4-[2-[7-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-3-yl]phenyl]-9-phenylcarbazole
CID 170192736
11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazole;11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzothiolo[3,2-b]carbazole
CID 159253152

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzofuran-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzothiophen-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;9-[3-[4-[4-(1-benzofuran-2-yl)phenyl]-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazin-2-yl]-5-carbazol-9-ylphenyl]carbazole?
The IUPAC name of 2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzofuran-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzothiophen-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;9-[3-[4-[4-(1-benzofuran-2-yl)phenyl]-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazin-2-yl]-5-carbazol-9-ylphenyl]carbazole (CID 157242372) is 2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzofuran-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzothiophen-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;9-[3-[4-[4-(1-benzofuran-2-yl)phenyl]-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazin-2-yl]-5-carbazol-9-ylphenyl]carbazole.
What is the SMILES notation for 2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzofuran-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzothiophen-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;9-[3-[4-[4-(1-benzofuran-2-yl)phenyl]-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazin-2-yl]-5-carbazol-9-ylphenyl]carbazole?
The canonical SMILES for 2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzofuran-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzothiophen-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;9-[3-[4-[4-(1-benzofuran-2-yl)phenyl]-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazin-2-yl]-5-carbazol-9-ylphenyl]carbazole is c1ccc2oc(-c3ccc(-c4nc(-c5ccc(-c6cccc7ccccc67)cc5)nc(-c5cc(-n6c7ccccc7c7ccccc76)cc(-n6c7ccccc7c7ccccc76)c5)n4)cc3)cc2c1.c1ccc2oc(-c3ccc(-c4nc(-c5ccc(-c6cccc7ccccc67)cc5)nc(-c5ccc6c(c5)oc5ccccc56)n4)cc3)cc2c1.c1ccc2oc(-c3ccc(-c4nc(-c5ccc(-c6cccc7ccccc67)cc5)nc(-c5ccc6c(c5)sc5ccccc56)n4)cc3)cc2c1.
What is the InChIKey of 2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzofuran-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzothiophen-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;9-[3-[4-[4-(1-benzofuran-2-yl)phenyl]-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazin-2-yl]-5-carbazol-9-ylphenyl]carbazole?
The InChIKey is AVIYUPXSJMGQNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H39N5O.C45H27N3O2.C45H27N3OS/c1-3-17-49-40(14-1)16-13-22-50(49)41-28-32-43(33-29-41)61-64-62(44-34-30-42(31-35-44)60-38-45-15-2-12-27-59(45)69-60)66-63(65-61)46-36-47(67-55-23-8-4-18-51(55)52-19-5-9-24-56(52)67)39-48(37-46)68-57-25-10-6-20-53(57)54-21-7-11-26-58(54)68;1-3-11-35-28(8-1)10-7-13-36(35)29-16-20-31(21-17-29)43-46-44(32-22-18-30(19-23-32)41-26-33-9-2-5-14-39(33)49-41)48-45(47-43)34-24-25-38-37-12-4-6-15-40(37)50-42(38)27-34;1-3-11-35-28(8-1)10-7-13-36(35)29-16-20-31(21-17-29)43-46-44(32-22-18-30(19-23-32)40-26-33-9-2-5-14-39(33)49-40)48-45(47-43)34-24-25-38-37-12-4-6-15-41(37)50-42(38)27-34/h1-39H;2*1-27H.
What are the key properties of 2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzofuran-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzothiophen-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;9-[3-[4-[4-(1-benzofuran-2-yl)phenyl]-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazin-2-yl]-5-carbazol-9-ylphenyl]carbazole?
2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzofuran-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzothiophen-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;9-[3-[4-[4-(1-benzofuran-2-yl)phenyl]-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazin-2-yl]-5-carbazol-9-ylphenyl]carbazole has a molecular weight of 2181.57 g/mol, XLogP of 40.78, 17 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzofuran-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;2-[4-(1-benzofuran-2-yl)phenyl]-4-dibenzothiophen-3-yl-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazine;9-[3-[4-[4-(1-benzofuran-2-yl)phenyl]-6-(4-naphthalen-1-ylphenyl)-1,3,5-triazin-2-yl]-5-carbazol-9-ylphenyl]carbazole is sourced from PubChem (CID 157242372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).