11-(3-phenylphenyl)-12-[4-(3-phenylphenyl)-6-[8-[3-[3-[12-[4-phenyl-6-(4-triphenylen-2-ylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazol-11-yl]phenyl]phenyl]triphenylen-2-yl]-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole

C126H76N10 — CID 170316172

IUPAC11-(3-phenylphenyl)-12-[4-(3-phenylphenyl)-6-[8-[3-[3-[12-[4-phenyl-6-(4-triphenylen-2-ylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazol-11-yl]phenyl]phenyl]triphenylen-2-yl]-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole
SMILESc1ccc(-c2cccc(-c3nc(-c4ccc5c(c4)c4ccccc4c4c(-c6cccc(-c7cccc(-n8c9ccccc9c9ccc%10c%11ccccc%11n(-c%11nc(-c%12ccccc%12)nc(-c%12ccc(-c%13ccc%14c%15ccccc%15c%15ccccc%15c%14c%13)cc%12)n%11)c%10c98)c7)c6)cccc54)nc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7cccc(-c8ccccc8)c7)c6c54)n3)c2)cc1
InChIInChI=1S/C126H76N10/c1-4-29-77(30-5-1)82-35-25-40-88(72-82)123-128-124(132-126(131-123)136-115-58-23-19-51-103(115)109-70-67-106-100-48-16-20-55-112(100)133(117(106)120(109)136)90-41-26-37-84(73-90)78-31-6-2-7-32-78)89-64-66-99-105-54-28-53-92(116(105)104-52-15-14-47-97(104)111(99)76-89)87-39-24-36-83(71-87)85-38-27-42-91(74-85)134-113-56-21-17-49-101(113)107-68-69-108-102-50-18-22-57-114(102)135(119(108)118(107)134)125-129-121(80-33-8-3-9-34-80)127-122(130-125)81-61-59-79(60-62-81)86-63-65-98-95-45-11-10-43-93(95)94-44-12-13-46-96(94)110(98)75-86/h1-76H
InChIKeyONZRLYCQLPPVNM-UHFFFAOYSA-N
MW1730.06 g/mol
LogP32.37
Rot. Bonds13

About 11-(3-phenylphenyl)-12-[4-(3-phenylphenyl)-6-[8-[3-[3-[12-[4-phenyl-6-(4-triphenylen-2-ylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazol-11-yl]phenyl]phenyl]triphenylen-2-yl]-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole

11-(3-phenylphenyl)-12-[4-(3-phenylphenyl)-6-[8-[3-[3-[12-[4-phenyl-6-(4-triphenylen-2-ylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazol-11-yl]phenyl]phenyl]triphenylen-2-yl]-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole (PubChem CID 170316172) has the molecular formula C126H76N10 and a molecular weight of 1730.06 g/mol. Its IUPAC name is 11-(3-phenylphenyl)-12-[4-(3-phenylphenyl)-6-[8-[3-[3-[12-[4-phenyl-6-(4-triphenylen-2-ylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazol-11-yl]phenyl]phenyl]triphenylen-2-yl]-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole.

Molecular Properties

Compound Name11-(3-phenylphenyl)-12-[4-(3-phenylphenyl)-6-[8-[3-[3-[12-[4-phenyl-6-(4-triphenylen-2-ylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazol-11-yl]phenyl]phenyl]triphenylen-2-yl]-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole
PubChem CID170316172
Molecular FormulaC126H76N10
Molecular Weight1730.06 g/mol
Exact Mass1728.63
IUPAC Name11-(3-phenylphenyl)-12-[4-(3-phenylphenyl)-6-[8-[3-[3-[12-[4-phenyl-6-(4-triphenylen-2-ylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazol-11-yl]phenyl]phenyl]triphenylen-2-yl]-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole
SMILESc1ccc(-c2cccc(-c3nc(-c4ccc5c(c4)c4ccccc4c4c(-c6cccc(-c7cccc(-n8c9ccccc9c9ccc%10c%11ccccc%11n(-c%11nc(-c%12ccccc%12)nc(-c%12ccc(-c%13ccc%14c%15ccccc%15c%15ccccc%15c%14c%13)cc%12)n%11)c%10c98)c7)c6)cccc54)nc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7cccc(-c8ccccc8)c7)c6c54)n3)c2)cc1
InChIInChI=1S/C126H76N10/c1-4-29-77(30-5-1)82-35-25-40-88(72-82)123-128-124(132-126(131-123)136-115-58-23-19-51-103(115)109-70-67-106-100-48-16-20-55-112(100)133(117(106)120(109)136)90-41-26-37-84(73-90)78-31-6-2-7-32-78)89-64-66-99-105-54-28-53-92(116(105)104-52-15-14-47-97(104)111(99)76-89)87-39-24-36-83(71-87)85-38-27-42-91(74-85)134-113-56-21-17-49-101(113)107-68-69-108-102-50-18-22-57-114(102)135(119(108)118(107)134)125-129-121(80-33-8-3-9-34-80)127-122(130-125)81-61-59-79(60-62-81)86-63-65-98-95-45-11-10-43-93(95)94-44-12-13-46-96(94)110(98)75-86/h1-76H
InChIKeyONZRLYCQLPPVNM-UHFFFAOYSA-N
XLogP32.37
TPSA97.06 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds13
Heavy Atoms136
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001730.06
LogP ≤ 532.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 11-(3-phenylphenyl)-12-[4-(3-phenylphenyl)-6-[8-[3-[3-[12-[4-phenyl-6-(4-triphenylen-2-ylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazol-11-yl]phenyl]phenyl]triphenylen-2-yl]-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole with MolForge

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Related Compounds

11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-12-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole
CID 169037513
11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-12-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole
CID 169037529
11-(3-phenylphenyl)-12-[4-phenyl-6-[4-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole
CID 167203855
12-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-11-[3-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]indolo[2,3-a]carbazole
CID 169037526
11-(3-phenylphenyl)-12-[4-phenyl-6-[9-(3-phenylphenyl)dibenzofuran-1-yl]-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole
CID 164758308
12-(3-phenylphenyl)-11-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-5-triphenylen-2-ylindolo[2,3-a]carbazole
CID 170255337
12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-(4-phenylphenyl)-4-[3-[4-[4-phenyl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]phenyl]phenyl]indolo[2,3-a]carbazole
CID 123867254
11-(3-phenylphenyl)-12-[4-phenyl-6-[9-[4-(3-phenylphenyl)phenyl]dibenzofuran-1-yl]-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole
CID 164758260
12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-[3-(3-phenylphenyl)phenyl]indolo[2,3-a]carbazole;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-[3-(4-phenylphenyl)phenyl]indolo[2,3-a]carbazole;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-[4-(3-phenylphenyl)phenyl]indolo[2,3-a]carbazole;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-[4-(4-phenylphenyl)phenyl]indolo[2,3-a]carbazole
CID 158055885
12-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-11-phenylindolo[2,3-a]carbazole;12-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole
CID 161432881
12-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-11-(3-phenylphenyl)indolo[2,3-a]carbazole
CID 170268449
11-phenyl-12-[3-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]indolo[2,3-a]carbazole
CID 169014169

Frequently Asked Questions

What is the IUPAC name of 11-(3-phenylphenyl)-12-[4-(3-phenylphenyl)-6-[8-[3-[3-[12-[4-phenyl-6-(4-triphenylen-2-ylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazol-11-yl]phenyl]phenyl]triphenylen-2-yl]-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole?
The IUPAC name of 11-(3-phenylphenyl)-12-[4-(3-phenylphenyl)-6-[8-[3-[3-[12-[4-phenyl-6-(4-triphenylen-2-ylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazol-11-yl]phenyl]phenyl]triphenylen-2-yl]-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole (CID 170316172) is 11-(3-phenylphenyl)-12-[4-(3-phenylphenyl)-6-[8-[3-[3-[12-[4-phenyl-6-(4-triphenylen-2-ylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazol-11-yl]phenyl]phenyl]triphenylen-2-yl]-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole.
What is the SMILES notation for 11-(3-phenylphenyl)-12-[4-(3-phenylphenyl)-6-[8-[3-[3-[12-[4-phenyl-6-(4-triphenylen-2-ylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazol-11-yl]phenyl]phenyl]triphenylen-2-yl]-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole?
The canonical SMILES for 11-(3-phenylphenyl)-12-[4-(3-phenylphenyl)-6-[8-[3-[3-[12-[4-phenyl-6-(4-triphenylen-2-ylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazol-11-yl]phenyl]phenyl]triphenylen-2-yl]-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole is c1ccc(-c2cccc(-c3nc(-c4ccc5c(c4)c4ccccc4c4c(-c6cccc(-c7cccc(-n8c9ccccc9c9ccc%10c%11ccccc%11n(-c%11nc(-c%12ccccc%12)nc(-c%12ccc(-c%13ccc%14c%15ccccc%15c%15ccccc%15c%14c%13)cc%12)n%11)c%10c98)c7)c6)cccc54)nc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7cccc(-c8ccccc8)c7)c6c54)n3)c2)cc1.
What is the InChIKey of 11-(3-phenylphenyl)-12-[4-(3-phenylphenyl)-6-[8-[3-[3-[12-[4-phenyl-6-(4-triphenylen-2-ylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazol-11-yl]phenyl]phenyl]triphenylen-2-yl]-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole?
The InChIKey is ONZRLYCQLPPVNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C126H76N10/c1-4-29-77(30-5-1)82-35-25-40-88(72-82)123-128-124(132-126(131-123)136-115-58-23-19-51-103(115)109-70-67-106-100-48-16-20-55-112(100)133(117(106)120(109)136)90-41-26-37-84(73-90)78-31-6-2-7-32-78)89-64-66-99-105-54-28-53-92(116(105)104-52-15-14-47-97(104)111(99)76-89)87-39-24-36-83(71-87)85-38-27-42-91(74-85)134-113-56-21-17-49-101(113)107-68-69-108-102-50-18-22-57-114(102)135(119(108)118(107)134)125-129-121(80-33-8-3-9-34-80)127-122(130-125)81-61-59-79(60-62-81)86-63-65-98-95-45-11-10-43-93(95)94-44-12-13-46-96(94)110(98)75-86/h1-76H.
What are the key properties of 11-(3-phenylphenyl)-12-[4-(3-phenylphenyl)-6-[8-[3-[3-[12-[4-phenyl-6-(4-triphenylen-2-ylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazol-11-yl]phenyl]phenyl]triphenylen-2-yl]-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole?
11-(3-phenylphenyl)-12-[4-(3-phenylphenyl)-6-[8-[3-[3-[12-[4-phenyl-6-(4-triphenylen-2-ylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazol-11-yl]phenyl]phenyl]triphenylen-2-yl]-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole has a molecular weight of 1730.06 g/mol, XLogP of 32.37, 13 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 11-(3-phenylphenyl)-12-[4-(3-phenylphenyl)-6-[8-[3-[3-[12-[4-phenyl-6-(4-triphenylen-2-ylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazol-11-yl]phenyl]phenyl]triphenylen-2-yl]-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole is sourced from PubChem (CID 170316172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).