12-(2,3-diphenylquinoxalin-5-yl)-11-phenylindolo[2,3-a]carbazole;12-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-(7-phenylquinoxalin-6-yl)indolo[2,3-a]carbazole

C132H84N12 — CID 159573481

IUPAC12-(2,3-diphenylquinoxalin-5-yl)-11-phenylindolo[2,3-a]carbazole;12-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-(7-phenylquinoxalin-6-yl)indolo[2,3-a]carbazole
SMILESc1ccc(-c2cc3nccnc3cc2-n2c3ccccc3c3ccc4c5ccccc5n(-c5ccccc5)c4c32)cc1.c1ccc(-c2nc3cccc(-c4cccc(-n5c6ccccc6c6ccc7c8ccccc8n(-c8ccccc8)c7c65)c4)c3nc2-c2ccccc2)cc1.c1ccc(-c2nc3cccc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)c3nc2-c2ccccc2)cc1
InChIInChI=1S/C50H32N4.C44H28N4.C38H24N4/c1-4-16-33(17-5-1)46-47(34-18-6-2-7-19-34)52-48-38(26-15-27-43(48)51-46)35-20-14-23-37(32-35)54-45-29-13-11-25-40(45)42-31-30-41-39-24-10-12-28-44(39)53(49(41)50(42)54)36-21-8-3-9-22-36;1-4-15-29(16-5-1)40-41(30-17-6-2-7-18-30)46-42-36(45-40)23-14-26-39(42)48-38-25-13-11-22-33(38)35-28-27-34-32-21-10-12-24-37(32)47(43(34)44(35)48)31-19-8-3-9-20-31;1-3-11-25(12-4-1)31-23-32-33(40-22-21-39-32)24-36(31)42-35-18-10-8-16-28(35)30-20-19-29-27-15-7-9-17-34(27)41(37(29)38(30)42)26-13-5-2-6-14-26/h1-32H;1-28H;1-24H
InChIKeyMICNDVJLOBRCJJ-UHFFFAOYSA-N
MW1838.21 g/mol
LogP33.47
Rot. Bonds12

About 12-(2,3-diphenylquinoxalin-5-yl)-11-phenylindolo[2,3-a]carbazole;12-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-(7-phenylquinoxalin-6-yl)indolo[2,3-a]carbazole

12-(2,3-diphenylquinoxalin-5-yl)-11-phenylindolo[2,3-a]carbazole;12-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-(7-phenylquinoxalin-6-yl)indolo[2,3-a]carbazole (PubChem CID 159573481) has the molecular formula C132H84N12 and a molecular weight of 1838.21 g/mol. Its IUPAC name is 12-(2,3-diphenylquinoxalin-5-yl)-11-phenylindolo[2,3-a]carbazole;12-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-(7-phenylquinoxalin-6-yl)indolo[2,3-a]carbazole.

Molecular Properties

Compound Name12-(2,3-diphenylquinoxalin-5-yl)-11-phenylindolo[2,3-a]carbazole;12-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-(7-phenylquinoxalin-6-yl)indolo[2,3-a]carbazole
PubChem CID159573481
Molecular FormulaC132H84N12
Molecular Weight1838.21 g/mol
Exact Mass1836.69
IUPAC Name12-(2,3-diphenylquinoxalin-5-yl)-11-phenylindolo[2,3-a]carbazole;12-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-(7-phenylquinoxalin-6-yl)indolo[2,3-a]carbazole
SMILESc1ccc(-c2cc3nccnc3cc2-n2c3ccccc3c3ccc4c5ccccc5n(-c5ccccc5)c4c32)cc1.c1ccc(-c2nc3cccc(-c4cccc(-n5c6ccccc6c6ccc7c8ccccc8n(-c8ccccc8)c7c65)c4)c3nc2-c2ccccc2)cc1.c1ccc(-c2nc3cccc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)c3nc2-c2ccccc2)cc1
InChIInChI=1S/C50H32N4.C44H28N4.C38H24N4/c1-4-16-33(17-5-1)46-47(34-18-6-2-7-19-34)52-48-38(26-15-27-43(48)51-46)35-20-14-23-37(32-35)54-45-29-13-11-25-40(45)42-31-30-41-39-24-10-12-28-44(39)53(49(41)50(42)54)36-21-8-3-9-22-36;1-4-15-29(16-5-1)40-41(30-17-6-2-7-18-30)46-42-36(45-40)23-14-26-39(42)48-38-25-13-11-22-33(38)35-28-27-34-32-21-10-12-24-37(32)47(43(34)44(35)48)31-19-8-3-9-20-31;1-3-11-25(12-4-1)31-23-32-33(40-22-21-39-32)24-36(31)42-35-18-10-8-16-28(35)30-20-19-29-27-15-7-9-17-34(27)41(37(29)38(30)42)26-13-5-2-6-14-26/h1-32H;1-28H;1-24H
InChIKeyMICNDVJLOBRCJJ-UHFFFAOYSA-N
XLogP33.47
TPSA106.92 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds12
Heavy Atoms144
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001838.21
LogP ≤ 533.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 12-(2,3-diphenylquinoxalin-5-yl)-11-phenylindolo[2,3-a]carbazole;12-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-(7-phenylquinoxalin-6-yl)indolo[2,3-a]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 12-(2,3-diphenylquinoxalin-5-yl)-11-phenylindolo[2,3-a]carbazole;12-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-(7-phenylquinoxalin-6-yl)indolo[2,3-a]carbazole?
The IUPAC name of 12-(2,3-diphenylquinoxalin-5-yl)-11-phenylindolo[2,3-a]carbazole;12-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-(7-phenylquinoxalin-6-yl)indolo[2,3-a]carbazole (CID 159573481) is 12-(2,3-diphenylquinoxalin-5-yl)-11-phenylindolo[2,3-a]carbazole;12-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-(7-phenylquinoxalin-6-yl)indolo[2,3-a]carbazole.
What is the SMILES notation for 12-(2,3-diphenylquinoxalin-5-yl)-11-phenylindolo[2,3-a]carbazole;12-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-(7-phenylquinoxalin-6-yl)indolo[2,3-a]carbazole?
The canonical SMILES for 12-(2,3-diphenylquinoxalin-5-yl)-11-phenylindolo[2,3-a]carbazole;12-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-(7-phenylquinoxalin-6-yl)indolo[2,3-a]carbazole is c1ccc(-c2cc3nccnc3cc2-n2c3ccccc3c3ccc4c5ccccc5n(-c5ccccc5)c4c32)cc1.c1ccc(-c2nc3cccc(-c4cccc(-n5c6ccccc6c6ccc7c8ccccc8n(-c8ccccc8)c7c65)c4)c3nc2-c2ccccc2)cc1.c1ccc(-c2nc3cccc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)c3nc2-c2ccccc2)cc1.
What is the InChIKey of 12-(2,3-diphenylquinoxalin-5-yl)-11-phenylindolo[2,3-a]carbazole;12-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-(7-phenylquinoxalin-6-yl)indolo[2,3-a]carbazole?
The InChIKey is MICNDVJLOBRCJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H32N4.C44H28N4.C38H24N4/c1-4-16-33(17-5-1)46-47(34-18-6-2-7-19-34)52-48-38(26-15-27-43(48)51-46)35-20-14-23-37(32-35)54-45-29-13-11-25-40(45)42-31-30-41-39-24-10-12-28-44(39)53(49(41)50(42)54)36-21-8-3-9-22-36;1-4-15-29(16-5-1)40-41(30-17-6-2-7-18-30)46-42-36(45-40)23-14-26-39(42)48-38-25-13-11-22-33(38)35-28-27-34-32-21-10-12-24-37(32)47(43(34)44(35)48)31-19-8-3-9-20-31;1-3-11-25(12-4-1)31-23-32-33(40-22-21-39-32)24-36(31)42-35-18-10-8-16-28(35)30-20-19-29-27-15-7-9-17-34(27)41(37(29)38(30)42)26-13-5-2-6-14-26/h1-32H;1-28H;1-24H.
What are the key properties of 12-(2,3-diphenylquinoxalin-5-yl)-11-phenylindolo[2,3-a]carbazole;12-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-(7-phenylquinoxalin-6-yl)indolo[2,3-a]carbazole?
12-(2,3-diphenylquinoxalin-5-yl)-11-phenylindolo[2,3-a]carbazole;12-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-(7-phenylquinoxalin-6-yl)indolo[2,3-a]carbazole has a molecular weight of 1838.21 g/mol, XLogP of 33.47, 12 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 12-(2,3-diphenylquinoxalin-5-yl)-11-phenylindolo[2,3-a]carbazole;12-[3-(2,3-diphenylquinoxalin-5-yl)phenyl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-(7-phenylquinoxalin-6-yl)indolo[2,3-a]carbazole is sourced from PubChem (CID 159573481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).