12-[7-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[7-(2,6-dinaphthalen-2-ylpyrimidin-4-yl)naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-[6-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-a]carbazole

C175H111N13 — CID 159811972

IUPAC12-[7-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[7-(2,6-dinaphthalen-2-ylpyrimidin-4-yl)naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-[6-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-a]carbazole
SMILESc1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc5ccc(-n6c7ccccc7c7ccc8c9ccccc9n(-c9ccccc9)c8c76)cc5c4)n3)cc2)cc1.c1ccc(-c2nc(-c3ccc4cc(-n5c6ccccc6c6ccc7c8ccccc8n(-c8ccccc8)c7c65)ccc4c3)nc(-c3ccccc3-c3ccccc3)n2)cc1.c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5ccc6ccc(-c7cc(-c8ccc9ccccc9c8)nc(-c8ccc9ccccc9c8)n7)cc6c5)c4c32)cc1
InChIInChI=1S/C62H40N4.C58H36N4.C55H35N5/c1-4-14-41(15-5-1)43-24-29-46(30-25-43)56-40-57(47-31-26-44(27-32-47)42-16-6-2-7-17-42)64-62(63-56)48-33-28-45-34-35-51(39-49(45)38-48)66-59-23-13-11-21-53(59)55-37-36-54-52-20-10-12-22-58(52)65(60(54)61(55)66)50-18-8-3-9-19-50;1-2-16-46(17-3-1)61-54-20-10-8-18-48(54)50-30-31-51-49-19-9-11-21-55(49)62(57(51)56(50)61)47-29-28-39-23-26-43(34-45(39)35-47)53-36-52(42-25-22-37-12-4-6-14-40(37)32-42)59-58(60-53)44-27-24-38-13-5-7-15-41(38)33-44;1-4-16-36(17-5-1)43-22-10-11-25-48(43)55-57-53(37-18-6-2-7-19-37)56-54(58-55)40-29-28-39-35-42(31-30-38(39)34-40)60-50-27-15-13-24-45(50)47-33-32-46-44-23-12-14-26-49(44)59(51(46)52(47)60)41-20-8-3-9-21-41/h1-40H;1-36H;1-35H
InChIKeyNLDKWQVRXVTSEP-UHFFFAOYSA-N
MW2395.90 g/mol
LogP45.18
Rot. Bonds18

About 12-[7-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[7-(2,6-dinaphthalen-2-ylpyrimidin-4-yl)naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-[6-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-a]carbazole

12-[7-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[7-(2,6-dinaphthalen-2-ylpyrimidin-4-yl)naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-[6-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-a]carbazole (PubChem CID 159811972) has the molecular formula C175H111N13 and a molecular weight of 2395.90 g/mol. Its IUPAC name is 12-[7-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[7-(2,6-dinaphthalen-2-ylpyrimidin-4-yl)naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-[6-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-a]carbazole.

Molecular Properties

Compound Name12-[7-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[7-(2,6-dinaphthalen-2-ylpyrimidin-4-yl)naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-[6-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-a]carbazole
PubChem CID159811972
Molecular FormulaC175H111N13
Molecular Weight2395.90 g/mol
Exact Mass2393.91
IUPAC Name12-[7-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[7-(2,6-dinaphthalen-2-ylpyrimidin-4-yl)naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-[6-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-a]carbazole
SMILESc1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc5ccc(-n6c7ccccc7c7ccc8c9ccccc9n(-c9ccccc9)c8c76)cc5c4)n3)cc2)cc1.c1ccc(-c2nc(-c3ccc4cc(-n5c6ccccc6c6ccc7c8ccccc8n(-c8ccccc8)c7c65)ccc4c3)nc(-c3ccccc3-c3ccccc3)n2)cc1.c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5ccc6ccc(-c7cc(-c8ccc9ccccc9c8)nc(-c8ccc9ccccc9c8)n7)cc6c5)c4c32)cc1
InChIInChI=1S/C62H40N4.C58H36N4.C55H35N5/c1-4-14-41(15-5-1)43-24-29-46(30-25-43)56-40-57(47-31-26-44(27-32-47)42-16-6-2-7-17-42)64-62(63-56)48-33-28-45-34-35-51(39-49(45)38-48)66-59-23-13-11-21-53(59)55-37-36-54-52-20-10-12-22-58(52)65(60(54)61(55)66)50-18-8-3-9-19-50;1-2-16-46(17-3-1)61-54-20-10-8-18-48(54)50-30-31-51-49-19-9-11-21-55(49)62(57(51)56(50)61)47-29-28-39-23-26-43(34-45(39)35-47)53-36-52(42-25-22-37-12-4-6-14-40(37)32-42)59-58(60-53)44-27-24-38-13-5-7-15-41(38)33-44;1-4-16-36(17-5-1)43-22-10-11-25-48(43)55-57-53(37-18-6-2-7-19-37)56-54(58-55)40-29-28-39-35-42(31-30-38(39)34-40)60-50-27-15-13-24-45(50)47-33-32-46-44-23-12-14-26-49(44)59(51(46)52(47)60)41-20-8-3-9-21-41/h1-40H;1-36H;1-35H
InChIKeyNLDKWQVRXVTSEP-UHFFFAOYSA-N
XLogP45.18
TPSA119.81 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds18
Heavy Atoms188
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002395.90
LogP ≤ 545.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Analyze 12-[7-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[7-(2,6-dinaphthalen-2-ylpyrimidin-4-yl)naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-[6-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-a]carbazole with MolForge

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Related Compounds

5-phenyl-12-[7-[4-phenyl-6-(2-phenylphenyl)pyrimidin-2-yl]naphthalen-2-yl]indolo[3,2-c]carbazole
CID 155240746
12-[3-(4,6-diphenyl-2-pyridinyl)phenyl]-11-phenylindolo[2,3-a]carbazole;12-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-11-phenylindolo[2,3-a]carbazole;12-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]indolo[2,3-a]carbazole
CID 161100572
7-phenyl-5-[7-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-2-yl]indolo[2,3-b]carbazole;7-phenyl-5-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-b]carbazole
CID 161361599
11-[3-[2-[4-phenyl-6-(6-phenylnaphthalen-2-yl)-1,3,5-triazin-2-yl]phenyl]phenyl]benzo[a]carbazole
CID 167031915
9-[3-[2-[4-naphthalen-2-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]carbazole
CID 167032128
11-[4-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]benzo[a]carbazole
CID 167032232
12-(3-phenylphenyl)-11-[4-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]indolo[2,3-a]carbazole
CID 121385286
11-[4-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]benzo[a]carbazole
CID 135245189
12-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-5-phenylindolo[3,2-c]carbazole;5-naphthalen-2-yl-12-[2-[6-phenyl-2-(2-phenylphenyl)pyrimidin-4-yl]phenyl]indolo[3,2-c]carbazole;12-[2-(2-naphthalen-1-yl-6-phenyl-4-pyridinyl)phenyl]-5-(2-phenylphenyl)indolo[3,2-c]carbazole;5-(3-phenylphenyl)-12-[2-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]phenyl]indolo[3,2-c]carbazole
CID 161194679
5-[3-(4,6-diphenylpyrimidin-2-yl)naphthalen-1-yl]-12-naphthalen-2-ylindolo[3,2-c]carbazole;12-phenyl-5-[7-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-2-yl]indolo[3,2-c]carbazole
CID 161246731
12-[2-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]-5-phenylindolo[3,2-c]carbazole;5-phenyl-12-[2-[2-phenyl-6-(3-phenylphenyl)-4-pyridinyl]phenyl]indolo[3,2-c]carbazole;5-phenyl-12-[2-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]phenyl]indolo[3,2-c]carbazole;5-phenyl-12-[2-[6-phenyl-2-(2-phenylphenyl)pyrimidin-4-yl]phenyl]indolo[3,2-c]carbazole
CID 158523648
2-[9-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]carbazol-3-yl]-9-phenylcarbazole;2-[9-(4,6-dinaphthalen-2-ylpyrimidin-2-yl)carbazol-3-yl]-9-phenylcarbazole;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-naphthalen-2-ylcarbazole
CID 159640568

Frequently Asked Questions

What is the IUPAC name of 12-[7-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[7-(2,6-dinaphthalen-2-ylpyrimidin-4-yl)naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-[6-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-a]carbazole?
The IUPAC name of 12-[7-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[7-(2,6-dinaphthalen-2-ylpyrimidin-4-yl)naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-[6-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-a]carbazole (CID 159811972) is 12-[7-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[7-(2,6-dinaphthalen-2-ylpyrimidin-4-yl)naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-[6-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-a]carbazole.
What is the SMILES notation for 12-[7-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[7-(2,6-dinaphthalen-2-ylpyrimidin-4-yl)naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-[6-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-a]carbazole?
The canonical SMILES for 12-[7-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[7-(2,6-dinaphthalen-2-ylpyrimidin-4-yl)naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-[6-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-a]carbazole is c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc5ccc(-n6c7ccccc7c7ccc8c9ccccc9n(-c9ccccc9)c8c76)cc5c4)n3)cc2)cc1.c1ccc(-c2nc(-c3ccc4cc(-n5c6ccccc6c6ccc7c8ccccc8n(-c8ccccc8)c7c65)ccc4c3)nc(-c3ccccc3-c3ccccc3)n2)cc1.c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5ccc6ccc(-c7cc(-c8ccc9ccccc9c8)nc(-c8ccc9ccccc9c8)n7)cc6c5)c4c32)cc1.
What is the InChIKey of 12-[7-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[7-(2,6-dinaphthalen-2-ylpyrimidin-4-yl)naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-[6-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-a]carbazole?
The InChIKey is NLDKWQVRXVTSEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H40N4.C58H36N4.C55H35N5/c1-4-14-41(15-5-1)43-24-29-46(30-25-43)56-40-57(47-31-26-44(27-32-47)42-16-6-2-7-17-42)64-62(63-56)48-33-28-45-34-35-51(39-49(45)38-48)66-59-23-13-11-21-53(59)55-37-36-54-52-20-10-12-22-58(52)65(60(54)61(55)66)50-18-8-3-9-19-50;1-2-16-46(17-3-1)61-54-20-10-8-18-48(54)50-30-31-51-49-19-9-11-21-55(49)62(57(51)56(50)61)47-29-28-39-23-26-43(34-45(39)35-47)53-36-52(42-25-22-37-12-4-6-14-40(37)32-42)59-58(60-53)44-27-24-38-13-5-7-15-41(38)33-44;1-4-16-36(17-5-1)43-22-10-11-25-48(43)55-57-53(37-18-6-2-7-19-37)56-54(58-55)40-29-28-39-35-42(31-30-38(39)34-40)60-50-27-15-13-24-45(50)47-33-32-46-44-23-12-14-26-49(44)59(51(46)52(47)60)41-20-8-3-9-21-41/h1-40H;1-36H;1-35H.
What are the key properties of 12-[7-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[7-(2,6-dinaphthalen-2-ylpyrimidin-4-yl)naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-[6-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-a]carbazole?
12-[7-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[7-(2,6-dinaphthalen-2-ylpyrimidin-4-yl)naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-[6-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-a]carbazole has a molecular weight of 2395.90 g/mol, XLogP of 45.18, 18 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 12-[7-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[7-(2,6-dinaphthalen-2-ylpyrimidin-4-yl)naphthalen-2-yl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-[6-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-a]carbazole is sourced from PubChem (CID 159811972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).