12-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-a]carbazole;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-b]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[3,2-b]carbazole

C171H105N15O3 — CID 163674877

IUPAC12-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-a]carbazole;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-b]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[3,2-b]carbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5cc(-n6c7ccccc7c7c(-c8ccccc8)cccc76)ccc5c5ccc6c7ccccc7oc6c54)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5cc6c(cc54)oc4cc(-n5c7ccccc7c7c(-c8ccccc8)cccc75)ccc46)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5cc6oc7cc(-n8c9ccccc9c9c(-c%10ccccc%10)cccc98)ccc7c6cc54)c3)n2)cc1
InChIInChI=1S/3C57H35N5O/c1-4-16-36(17-5-1)42-26-15-28-49-52(42)47-25-10-12-27-48(47)61(49)41-30-31-43-45-32-33-46-44-24-11-13-29-51(44)63-54(46)53(45)62(50(43)35-41)40-23-14-22-39(34-40)57-59-55(37-18-6-2-7-19-37)58-56(60-57)38-20-8-3-9-21-38;1-4-16-36(17-5-1)42-26-15-29-50-54(42)45-25-11-13-28-49(45)61(50)41-30-31-44-47-34-51-46(35-53(47)63-52(44)33-41)43-24-10-12-27-48(43)62(51)40-23-14-22-39(32-40)57-59-55(37-18-6-2-7-19-37)58-56(60-57)38-20-8-3-9-21-38;1-4-16-36(17-5-1)42-26-15-29-50-54(42)45-25-11-13-28-49(45)61(50)41-30-31-44-47-34-46-43-24-10-12-27-48(43)62(51(46)35-53(47)63-52(44)33-41)40-23-14-22-39(32-40)57-59-55(37-18-6-2-7-19-37)58-56(60-57)38-20-8-3-9-21-38/h3*1-35H
InChIKeyJFUCRTDXCBCFMJ-UHFFFAOYSA-N
MW2417.82 g/mol
LogP43.90
Rot. Bonds18

About 12-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-a]carbazole;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-b]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[3,2-b]carbazole

12-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-a]carbazole;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-b]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[3,2-b]carbazole (PubChem CID 163674877) has the molecular formula C171H105N15O3 and a molecular weight of 2417.82 g/mol. Its IUPAC name is 12-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-a]carbazole;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-b]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[3,2-b]carbazole.

Molecular Properties

Compound Name12-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-a]carbazole;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-b]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[3,2-b]carbazole
PubChem CID163674877
Molecular FormulaC171H105N15O3
Molecular Weight2417.82 g/mol
Exact Mass2415.85
IUPAC Name12-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-a]carbazole;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-b]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[3,2-b]carbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5cc(-n6c7ccccc7c7c(-c8ccccc8)cccc76)ccc5c5ccc6c7ccccc7oc6c54)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5cc6c(cc54)oc4cc(-n5c7ccccc7c7c(-c8ccccc8)cccc75)ccc46)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5cc6oc7cc(-n8c9ccccc9c9c(-c%10ccccc%10)cccc98)ccc7c6cc54)c3)n2)cc1
InChIInChI=1S/3C57H35N5O/c1-4-16-36(17-5-1)42-26-15-28-49-52(42)47-25-10-12-27-48(47)61(49)41-30-31-43-45-32-33-46-44-24-11-13-29-51(44)63-54(46)53(45)62(50(43)35-41)40-23-14-22-39(34-40)57-59-55(37-18-6-2-7-19-37)58-56(60-57)38-20-8-3-9-21-38;1-4-16-36(17-5-1)42-26-15-29-50-54(42)45-25-11-13-28-49(45)61(50)41-30-31-44-47-34-51-46(35-53(47)63-52(44)33-41)43-24-10-12-27-48(43)62(51)40-23-14-22-39(32-40)57-59-55(37-18-6-2-7-19-37)58-56(60-57)38-20-8-3-9-21-38;1-4-16-36(17-5-1)42-26-15-29-50-54(42)45-25-11-13-28-49(45)61(50)41-30-31-44-47-34-46-43-24-10-12-27-48(43)62(51(46)35-53(47)63-52(44)33-41)40-23-14-22-39(32-40)57-59-55(37-18-6-2-7-19-37)58-56(60-57)38-20-8-3-9-21-38/h3*1-35H
InChIKeyJFUCRTDXCBCFMJ-UHFFFAOYSA-N
XLogP43.90
TPSA185.01 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds18
Heavy Atoms189
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002417.82
LogP ≤ 543.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 12-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-a]carbazole;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-b]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[3,2-b]carbazole with MolForge

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Related Compounds

11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-10-[4-[9-[7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazol-3-yl]carbazol-4-yl]phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[3,2-b]carbazole
CID 166836362
3-carbazol-9-yl-11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9-[9-[7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazol-3-yl]carbazol-4-yl]-[1]benzofuro[3,2-b]carbazole
CID 166836389
9-[3-[4-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylcarbazole;9-[3-[4-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenylcarbazole
CID 165093740
5-[3-(4-dibenzofuran-3-yl-6-dibenzofuran-4-yl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole
CID 162362950
25-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-15-phenyl-11-oxa-15,25-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17,19,21,23,26-dodecaene
CID 140957385
12-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-a]carbazole;12-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9-(4-phenylcarbazol-9-yl)-[1]benzothiolo[2,3-a]carbazole;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(3-phenylcarbazol-9-yl)-[1]benzothiolo[2,3-b]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(3-phenylcarbazol-9-yl)-[1]benzothiolo[3,2-b]carbazole;14-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-17-(4-phenylcarbazol-9-yl)-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15(20),16,18-nonaene
CID 163769068
12-phenyl-5-[4-[4-phenyl-6-(6-phenyldibenzofuran-3-yl)-1,3,5-triazin-2-yl]phenyl]indolo[3,2-c]carbazole
CID 169014994
5-[3-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole
CID 169014926
7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9-(2-phenylcarbazol-9-yl)-[1]benzofuro[2,3-b]carbazole
CID 155006709
3-phenyl-12-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-[1]benzofuro[2,3-a]carbazole;4-phenyl-12-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-[1]benzofuro[2,3-a]carbazole;7-[2-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-[1]benzofuro[2,3-b]carbazole
CID 163926032
12-[3-(4-phenylphenyl)phenyl]-9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-[1]benzofuro[2,3-a]carbazole
CID 163675437
9-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-phenyl-1-(9-phenylcarbazol-1-yl)-[1]benzofuro[2,3-a]carbazole
CID 171591603

Frequently Asked Questions

What is the IUPAC name of 12-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-a]carbazole;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-b]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[3,2-b]carbazole?
The IUPAC name of 12-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-a]carbazole;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-b]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[3,2-b]carbazole (CID 163674877) is 12-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-a]carbazole;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-b]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[3,2-b]carbazole.
What is the SMILES notation for 12-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-a]carbazole;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-b]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[3,2-b]carbazole?
The canonical SMILES for 12-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-a]carbazole;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-b]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[3,2-b]carbazole is c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5cc(-n6c7ccccc7c7c(-c8ccccc8)cccc76)ccc5c5ccc6c7ccccc7oc6c54)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5cc6c(cc54)oc4cc(-n5c7ccccc7c7c(-c8ccccc8)cccc75)ccc46)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5cc6oc7cc(-n8c9ccccc9c9c(-c%10ccccc%10)cccc98)ccc7c6cc54)c3)n2)cc1.
What is the InChIKey of 12-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-a]carbazole;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-b]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[3,2-b]carbazole?
The InChIKey is JFUCRTDXCBCFMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/3C57H35N5O/c1-4-16-36(17-5-1)42-26-15-28-49-52(42)47-25-10-12-27-48(47)61(49)41-30-31-43-45-32-33-46-44-24-11-13-29-51(44)63-54(46)53(45)62(50(43)35-41)40-23-14-22-39(34-40)57-59-55(37-18-6-2-7-19-37)58-56(60-57)38-20-8-3-9-21-38;1-4-16-36(17-5-1)42-26-15-29-50-54(42)45-25-11-13-28-49(45)61(50)41-30-31-44-47-34-51-46(35-53(47)63-52(44)33-41)43-24-10-12-27-48(43)62(51)40-23-14-22-39(32-40)57-59-55(37-18-6-2-7-19-37)58-56(60-57)38-20-8-3-9-21-38;1-4-16-36(17-5-1)42-26-15-29-50-54(42)45-25-11-13-28-49(45)61(50)41-30-31-44-47-34-46-43-24-10-12-27-48(43)62(51(46)35-53(47)63-52(44)33-41)40-23-14-22-39(32-40)57-59-55(37-18-6-2-7-19-37)58-56(60-57)38-20-8-3-9-21-38/h3*1-35H.
What are the key properties of 12-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-a]carbazole;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-b]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[3,2-b]carbazole?
12-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-a]carbazole;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-b]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[3,2-b]carbazole has a molecular weight of 2417.82 g/mol, XLogP of 43.90, 18 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 12-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-a]carbazole;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[2,3-b]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylcarbazol-9-yl)-[1]benzofuro[3,2-b]carbazole is sourced from PubChem (CID 163674877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).