5-[5-(2,6-diphenylpyrimidin-4-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole

C115H73N11 — CID 157484056

IUPAC5-[5-(2,6-diphenylpyrimidin-4-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole
SMILESc1ccc(-c2cc(-c3cccc4c3c3cccc(-n5c6ccccc6c6c5ccc5c7ccccc7n(-c7ccccc7)c56)c3n4-c3ccccc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3c3cccc(-n5c6ccccc6c6c5ccc5c7ccccc7n(-c7ccccc7)c56)c3n4-c3ccccc3)n2)cc1
InChIInChI=1S/C58H37N5.C57H36N6/c1-5-19-38(20-6-1)47-37-48(60-58(59-47)39-21-7-2-8-22-39)44-29-17-33-51-54(44)46-30-18-34-53(56(46)62(51)41-25-11-4-12-26-41)63-50-32-16-14-28-45(50)55-52(63)36-35-43-42-27-13-15-31-49(42)61(57(43)55)40-23-9-3-10-24-40;1-5-19-37(20-6-1)55-58-56(38-21-7-2-8-22-38)60-57(59-55)45-30-18-33-48-51(45)44-29-17-34-50(53(44)62(48)40-25-11-4-12-26-40)63-47-32-16-14-28-43(47)52-49(63)36-35-42-41-27-13-15-31-46(41)61(54(42)52)39-23-9-3-10-24-39/h1-37H;1-36H
InChIKeyBWMPHTACBUWWTN-UHFFFAOYSA-N
MW1608.93 g/mol
LogP28.93
Rot. Bonds12

About 5-[5-(2,6-diphenylpyrimidin-4-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole

5-[5-(2,6-diphenylpyrimidin-4-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole (PubChem CID 157484056) has the molecular formula C115H73N11 and a molecular weight of 1608.93 g/mol. Its IUPAC name is 5-[5-(2,6-diphenylpyrimidin-4-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole.

Molecular Properties

Compound Name5-[5-(2,6-diphenylpyrimidin-4-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole
PubChem CID157484056
Molecular FormulaC115H73N11
Molecular Weight1608.93 g/mol
Exact Mass1607.61
IUPAC Name5-[5-(2,6-diphenylpyrimidin-4-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole
SMILESc1ccc(-c2cc(-c3cccc4c3c3cccc(-n5c6ccccc6c6c5ccc5c7ccccc7n(-c7ccccc7)c56)c3n4-c3ccccc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3c3cccc(-n5c6ccccc6c6c5ccc5c7ccccc7n(-c7ccccc7)c56)c3n4-c3ccccc3)n2)cc1
InChIInChI=1S/C58H37N5.C57H36N6/c1-5-19-38(20-6-1)47-37-48(60-58(59-47)39-21-7-2-8-22-39)44-29-17-33-51-54(44)46-30-18-34-53(56(46)62(51)41-25-11-4-12-26-41)63-50-32-16-14-28-45(50)55-52(63)36-35-43-42-27-13-15-31-49(42)61(57(43)55)40-23-9-3-10-24-40;1-5-19-37(20-6-1)55-58-56(38-21-7-2-8-22-38)60-57(59-55)45-30-18-33-48-51(45)44-29-17-34-50(53(44)62(48)40-25-11-4-12-26-40)63-47-32-16-14-28-43(47)52-49(63)36-35-42-41-27-13-15-31-46(41)61(54(42)52)39-23-9-3-10-24-39/h1-37H;1-36H
InChIKeyBWMPHTACBUWWTN-UHFFFAOYSA-N
XLogP28.93
TPSA94.03 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds12
Heavy Atoms126
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001608.93
LogP ≤ 528.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 5-[5-(2,6-diphenylpyrimidin-4-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole with MolForge

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Related Compounds

8-(2,6-diphenylpyrimidin-4-yl)-5,12-diphenyl-2-(12-phenylindolo[3,2-c]carbazol-5-yl)indolo[3,2-c]carbazole
CID 134598091
5-[2-(4,6-diphenylpyrimidin-2-yl)phenyl]-12-phenylindolo[3,2-c]carbazole
CID 139497018
5-[4-(2,6-diphenylpyrimidin-4-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole
CID 134597921
12-(3-phenylphenyl)-5-[2-[6-phenyl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]indolo[3,2-c]carbazole
CID 155240321
6-(2,6-diphenylpyrimidin-4-yl)-12-phenyl-5-(9-phenylcarbazol-1-yl)indolo[3,2-c]carbazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-phenyl-5-(9-phenylcarbazol-1-yl)indolo[3,2-c]carbazole;12-phenyl-5-(9-phenylcarbazol-1-yl)indolo[2,3-g]carbazole-4-carbonitrile
CID 161026535
5-[2-(2-carbazol-9-ylphenyl)-4-(2,6-diphenylpyrimidin-4-yl)phenyl]-12-phenylindolo[3,2-c]carbazole
CID 155463086
5-[3-[2-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-12-phenylindolo[3,2-c]carbazole
CID 155240549
5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole
CID 134597913
5-[2-(2,6-diphenylpyrimidin-4-yl)phenyl]-12-naphthalen-1-ylindolo[3,2-c]carbazole
CID 155631323
4-(2,6-diphenylpyrimidin-4-yl)-5,12-diphenyl-2-(5-phenylindolo[3,2-c]carbazol-12-yl)indolo[3,2-c]carbazole
CID 134598177
5-[2-[4-(3-methylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-12-phenylindolo[3,2-c]carbazole
CID 155183616
12-phenyl-5-[4-[6-phenyl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]indolo[3,2-c]carbazole
CID 139496601

Frequently Asked Questions

What is the IUPAC name of 5-[5-(2,6-diphenylpyrimidin-4-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole?
The IUPAC name of 5-[5-(2,6-diphenylpyrimidin-4-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole (CID 157484056) is 5-[5-(2,6-diphenylpyrimidin-4-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole.
What is the SMILES notation for 5-[5-(2,6-diphenylpyrimidin-4-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole?
The canonical SMILES for 5-[5-(2,6-diphenylpyrimidin-4-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole is c1ccc(-c2cc(-c3cccc4c3c3cccc(-n5c6ccccc6c6c5ccc5c7ccccc7n(-c7ccccc7)c56)c3n4-c3ccccc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3c3cccc(-n5c6ccccc6c6c5ccc5c7ccccc7n(-c7ccccc7)c56)c3n4-c3ccccc3)n2)cc1.
What is the InChIKey of 5-[5-(2,6-diphenylpyrimidin-4-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole?
The InChIKey is BWMPHTACBUWWTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H37N5.C57H36N6/c1-5-19-38(20-6-1)47-37-48(60-58(59-47)39-21-7-2-8-22-39)44-29-17-33-51-54(44)46-30-18-34-53(56(46)62(51)41-25-11-4-12-26-41)63-50-32-16-14-28-45(50)55-52(63)36-35-43-42-27-13-15-31-49(42)61(57(43)55)40-23-9-3-10-24-40;1-5-19-37(20-6-1)55-58-56(38-21-7-2-8-22-38)60-57(59-55)45-30-18-33-48-51(45)44-29-17-34-50(53(44)62(48)40-25-11-4-12-26-40)63-47-32-16-14-28-43(47)52-49(63)36-35-42-41-27-13-15-31-46(41)61(54(42)52)39-23-9-3-10-24-39/h1-37H;1-36H.
What are the key properties of 5-[5-(2,6-diphenylpyrimidin-4-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole?
5-[5-(2,6-diphenylpyrimidin-4-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole has a molecular weight of 1608.93 g/mol, XLogP of 28.93, 12 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-(2,6-diphenylpyrimidin-4-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole;5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-1-yl]-12-phenylindolo[3,2-c]carbazole is sourced from PubChem (CID 157484056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).