5,11-bis(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-b]carbazole;11-(2,6-diphenyl-4-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenyl-2-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenylpyrimidin-2-yl)-5-phenylindolo[3,2-b]carbazole

C170H110N18 — CID 157399979

IUPAC5,11-bis(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-b]carbazole;11-(2,6-diphenyl-4-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenyl-2-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenylpyrimidin-2-yl)-5-phenylindolo[3,2-b]carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3ccccc3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3ccccc3)n2)cc1.c1ccc(-c2cc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3ccccc3)cc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)n2)cc1
InChIInChI=1S/C48H30N8.2C41H27N3.C40H26N4/c1-5-17-31(18-6-1)43-49-44(32-19-7-2-8-20-32)52-47(51-43)55-39-27-15-13-25-35(39)37-30-42-38(29-41(37)55)36-26-14-16-28-40(36)56(42)48-53-45(33-21-9-3-10-22-33)50-46(54-48)34-23-11-4-12-24-34;1-4-14-28(15-5-1)30-24-36(29-16-6-2-7-17-29)42-41(25-30)44-38-23-13-11-21-33(38)35-26-39-34(27-40(35)44)32-20-10-12-22-37(32)43(39)31-18-8-3-9-19-31;1-4-14-28(15-5-1)36-24-31(25-37(42-36)29-16-6-2-7-17-29)44-39-23-13-11-21-33(39)35-26-40-34(27-41(35)44)32-20-10-12-22-38(32)43(40)30-18-8-3-9-19-30;1-4-14-27(15-5-1)34-26-35(28-16-6-2-7-17-28)42-40(41-34)44-37-23-13-11-21-31(37)33-24-38-32(25-39(33)44)30-20-10-12-22-36(30)43(38)29-18-8-3-9-19-29/h1-30H;2*1-27H;1-26H
InChIKeyBNAOALRWSZCESB-UHFFFAOYSA-N
MW2404.88 g/mol
LogP42.14
Rot. Bonds18

About 5,11-bis(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-b]carbazole;11-(2,6-diphenyl-4-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenyl-2-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenylpyrimidin-2-yl)-5-phenylindolo[3,2-b]carbazole

5,11-bis(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-b]carbazole;11-(2,6-diphenyl-4-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenyl-2-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenylpyrimidin-2-yl)-5-phenylindolo[3,2-b]carbazole (PubChem CID 157399979) has the molecular formula C170H110N18 and a molecular weight of 2404.88 g/mol. Its IUPAC name is 5,11-bis(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-b]carbazole;11-(2,6-diphenyl-4-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenyl-2-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenylpyrimidin-2-yl)-5-phenylindolo[3,2-b]carbazole.

Molecular Properties

Compound Name5,11-bis(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-b]carbazole;11-(2,6-diphenyl-4-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenyl-2-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenylpyrimidin-2-yl)-5-phenylindolo[3,2-b]carbazole
PubChem CID157399979
Molecular FormulaC170H110N18
Molecular Weight2404.88 g/mol
Exact Mass2402.92
IUPAC Name5,11-bis(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-b]carbazole;11-(2,6-diphenyl-4-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenyl-2-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenylpyrimidin-2-yl)-5-phenylindolo[3,2-b]carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3ccccc3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3ccccc3)n2)cc1.c1ccc(-c2cc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3ccccc3)cc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)n2)cc1
InChIInChI=1S/C48H30N8.2C41H27N3.C40H26N4/c1-5-17-31(18-6-1)43-49-44(32-19-7-2-8-20-32)52-47(51-43)55-39-27-15-13-25-35(39)37-30-42-38(29-41(37)55)36-26-14-16-28-40(36)56(42)48-53-45(33-21-9-3-10-22-33)50-46(54-48)34-23-11-4-12-24-34;1-4-14-28(15-5-1)30-24-36(29-16-6-2-7-17-29)42-41(25-30)44-38-23-13-11-21-33(38)35-26-39-34(27-40(35)44)32-20-10-12-22-37(32)43(39)31-18-8-3-9-19-31;1-4-14-28(15-5-1)36-24-31(25-37(42-36)29-16-6-2-7-17-29)44-39-23-13-11-21-33(39)35-26-40-34(27-41(35)44)32-20-10-12-22-38(32)43(40)30-18-8-3-9-19-30;1-4-14-27(15-5-1)34-26-35(28-16-6-2-7-17-28)42-40(41-34)44-37-23-13-11-21-31(37)33-24-38-32(25-39(33)44)30-20-10-12-22-36(30)43(38)29-18-8-3-9-19-29/h1-30H;2*1-27H;1-26H
InChIKeyBNAOALRWSZCESB-UHFFFAOYSA-N
XLogP42.14
TPSA168.34 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds18
Heavy Atoms188
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002404.88
LogP ≤ 542.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 5,11-bis(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-b]carbazole;11-(2,6-diphenyl-4-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenyl-2-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenylpyrimidin-2-yl)-5-phenylindolo[3,2-b]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5,11-bis(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-b]carbazole;11-(2,6-diphenyl-4-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenyl-2-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenylpyrimidin-2-yl)-5-phenylindolo[3,2-b]carbazole?
The IUPAC name of 5,11-bis(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-b]carbazole;11-(2,6-diphenyl-4-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenyl-2-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenylpyrimidin-2-yl)-5-phenylindolo[3,2-b]carbazole (CID 157399979) is 5,11-bis(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-b]carbazole;11-(2,6-diphenyl-4-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenyl-2-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenylpyrimidin-2-yl)-5-phenylindolo[3,2-b]carbazole.
What is the SMILES notation for 5,11-bis(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-b]carbazole;11-(2,6-diphenyl-4-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenyl-2-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenylpyrimidin-2-yl)-5-phenylindolo[3,2-b]carbazole?
The canonical SMILES for 5,11-bis(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-b]carbazole;11-(2,6-diphenyl-4-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenyl-2-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenylpyrimidin-2-yl)-5-phenylindolo[3,2-b]carbazole is c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3ccccc3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3ccccc3)n2)cc1.c1ccc(-c2cc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3ccccc3)cc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)n2)cc1.
What is the InChIKey of 5,11-bis(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-b]carbazole;11-(2,6-diphenyl-4-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenyl-2-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenylpyrimidin-2-yl)-5-phenylindolo[3,2-b]carbazole?
The InChIKey is BNAOALRWSZCESB-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H30N8.2C41H27N3.C40H26N4/c1-5-17-31(18-6-1)43-49-44(32-19-7-2-8-20-32)52-47(51-43)55-39-27-15-13-25-35(39)37-30-42-38(29-41(37)55)36-26-14-16-28-40(36)56(42)48-53-45(33-21-9-3-10-22-33)50-46(54-48)34-23-11-4-12-24-34;1-4-14-28(15-5-1)30-24-36(29-16-6-2-7-17-29)42-41(25-30)44-38-23-13-11-21-33(38)35-26-39-34(27-40(35)44)32-20-10-12-22-37(32)43(39)31-18-8-3-9-19-31;1-4-14-28(15-5-1)36-24-31(25-37(42-36)29-16-6-2-7-17-29)44-39-23-13-11-21-33(39)35-26-40-34(27-41(35)44)32-20-10-12-22-38(32)43(40)30-18-8-3-9-19-30;1-4-14-27(15-5-1)34-26-35(28-16-6-2-7-17-28)42-40(41-34)44-37-23-13-11-21-31(37)33-24-38-32(25-39(33)44)30-20-10-12-22-36(30)43(38)29-18-8-3-9-19-29/h1-30H;2*1-27H;1-26H.
What are the key properties of 5,11-bis(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-b]carbazole;11-(2,6-diphenyl-4-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenyl-2-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenylpyrimidin-2-yl)-5-phenylindolo[3,2-b]carbazole?
5,11-bis(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-b]carbazole;11-(2,6-diphenyl-4-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenyl-2-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenylpyrimidin-2-yl)-5-phenylindolo[3,2-b]carbazole has a molecular weight of 2404.88 g/mol, XLogP of 42.14, 18 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 5,11-bis(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[3,2-b]carbazole;11-(2,6-diphenyl-4-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenyl-2-pyridinyl)-5-phenylindolo[3,2-b]carbazole;11-(4,6-diphenylpyrimidin-2-yl)-5-phenylindolo[3,2-b]carbazole is sourced from PubChem (CID 157399979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).