3-[11-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazol-2-yl]-11-[3-(1,2-dihydrocarbazol-9-yl)phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole

C102H64N12 — CID 170317164

IUPAC3-[11-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazol-2-yl]-11-[3-(1,2-dihydrocarbazol-9-yl)phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole
SMILESC1=Cc2c(n(-c3cccc(-n4c5ccccc5c5ccc6c7cc(-c8ccc9c%10ccc%11c%12ccccc%12n(-c%12nc(-c%13ccccc%13)nc(-c%13cccc(-n%14c%15ccccc%15c%15ccccc%15%14)c%13)n%12)c%11c%10n(-c%10ccccc%10)c9c8)ccc7n(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)c6c54)c3)c3ccccc23)CC1
InChIInChI=1S/C102H64N12/c1-5-27-63(28-6-1)97-103-98(64-29-7-2-8-30-64)106-101(105-97)114-91-58-52-66(60-84(91)83-57-56-80-77-43-17-23-49-89(77)112(94(80)96(83)114)72-38-26-37-71(62-72)110-87-47-21-15-41-75(87)76-42-16-22-48-88(76)110)67-51-53-79-82-55-54-81-78-44-18-24-50-90(78)113(95(81)93(82)111(92(79)61-67)69-34-11-4-12-35-69)102-107-99(65-31-9-3-10-32-65)104-100(108-102)68-33-25-36-70(59-68)109-85-45-19-13-39-73(85)74-40-14-20-46-86(74)109/h1-21,23-47,49-62H,22,48H2
InChIKeyPYQMKEZOYHUBRY-UHFFFAOYSA-N
MW1457.72 g/mol
LogP24.78
Rot. Bonds11

About 3-[11-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazol-2-yl]-11-[3-(1,2-dihydrocarbazol-9-yl)phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole

3-[11-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazol-2-yl]-11-[3-(1,2-dihydrocarbazol-9-yl)phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole (PubChem CID 170317164) has the molecular formula C102H64N12 and a molecular weight of 1457.72 g/mol. Its IUPAC name is 3-[11-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazol-2-yl]-11-[3-(1,2-dihydrocarbazol-9-yl)phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole.

Molecular Properties

Compound Name3-[11-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazol-2-yl]-11-[3-(1,2-dihydrocarbazol-9-yl)phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole
PubChem CID170317164
Molecular FormulaC102H64N12
Molecular Weight1457.72 g/mol
Exact Mass1456.54
IUPAC Name3-[11-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazol-2-yl]-11-[3-(1,2-dihydrocarbazol-9-yl)phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole
SMILESC1=Cc2c(n(-c3cccc(-n4c5ccccc5c5ccc6c7cc(-c8ccc9c%10ccc%11c%12ccccc%12n(-c%12nc(-c%13ccccc%13)nc(-c%13cccc(-n%14c%15ccccc%15c%15ccccc%15%14)c%13)n%12)c%11c%10n(-c%10ccccc%10)c9c8)ccc7n(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)c6c54)c3)c3ccccc23)CC1
InChIInChI=1S/C102H64N12/c1-5-27-63(28-6-1)97-103-98(64-29-7-2-8-30-64)106-101(105-97)114-91-58-52-66(60-84(91)83-57-56-80-77-43-17-23-49-89(77)112(94(80)96(83)114)72-38-26-37-71(62-72)110-87-47-21-15-41-75(87)76-42-16-22-48-88(76)110)67-51-53-79-82-55-54-81-78-44-18-24-50-90(78)113(95(81)93(82)111(92(79)61-67)69-34-11-4-12-35-69)102-107-99(65-31-9-3-10-32-65)104-100(108-102)68-33-25-36-70(59-68)109-85-45-19-13-39-73(85)74-40-14-20-46-86(74)109/h1-21,23-47,49-62H,22,48H2
InChIKeyPYQMKEZOYHUBRY-UHFFFAOYSA-N
XLogP24.78
TPSA106.92 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds11
Heavy Atoms114
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001457.72
LogP ≤ 524.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 3-[11-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazol-2-yl]-11-[3-(1,2-dihydrocarbazol-9-yl)phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole with MolForge

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Related Compounds

3-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7,8-dihydrocarbazol-3-yl]-9-phenylcarbazole
CID 67950571
9-[3-[4-(3-phenylphenyl)-6-[4-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1,2-dihydrocarbazole
CID 126627650
11-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-5-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-9,10-dihydroindolo[3,2-b]carbazole
CID 170138762
12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-a]carbazole;11-phenyl-12-[3-[4-phenyl-6-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]indolo[2,3-a]carbazole;5-phenyl-11-[4-phenyl-6-(11-phenylindolo[2,3-a]carbazol-12-yl)-1,3,5-triazin-2-yl]indolo[3,2-b]carbazole
CID 163926975
9-phenyl-2-(9-phenyl-7,8-dihydrocarbazol-2-yl)carbazole
CID 144650170
11-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-5-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-9,10-dihydroindolo[3,2-b]carbazole
CID 170137926
12-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-5-phenyl-3,4-dihydroindolo[3,2-c]carbazole
CID 170205976
3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole;12-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-11-phenylindolo[2,3-a]carbazole
CID 160782385
5-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-7-phenyl-8,9-dihydroindolo[2,3-b]carbazole
CID 149205020
3-carbazol-9-yl-12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-(3-triphenylen-2-ylphenyl)indolo[2,3-a]carbazole
CID 168729461
11-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-3-carbazol-9-yl-12-(3-phenylphenyl)indolo[2,3-a]carbazole
CID 168729405
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

Frequently Asked Questions

What is the IUPAC name of 3-[11-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazol-2-yl]-11-[3-(1,2-dihydrocarbazol-9-yl)phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole?
The IUPAC name of 3-[11-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazol-2-yl]-11-[3-(1,2-dihydrocarbazol-9-yl)phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole (CID 170317164) is 3-[11-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazol-2-yl]-11-[3-(1,2-dihydrocarbazol-9-yl)phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole.
What is the SMILES notation for 3-[11-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazol-2-yl]-11-[3-(1,2-dihydrocarbazol-9-yl)phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole?
The canonical SMILES for 3-[11-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazol-2-yl]-11-[3-(1,2-dihydrocarbazol-9-yl)phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole is C1=Cc2c(n(-c3cccc(-n4c5ccccc5c5ccc6c7cc(-c8ccc9c%10ccc%11c%12ccccc%12n(-c%12nc(-c%13ccccc%13)nc(-c%13cccc(-n%14c%15ccccc%15c%15ccccc%15%14)c%13)n%12)c%11c%10n(-c%10ccccc%10)c9c8)ccc7n(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)c6c54)c3)c3ccccc23)CC1.
What is the InChIKey of 3-[11-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazol-2-yl]-11-[3-(1,2-dihydrocarbazol-9-yl)phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole?
The InChIKey is PYQMKEZOYHUBRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C102H64N12/c1-5-27-63(28-6-1)97-103-98(64-29-7-2-8-30-64)106-101(105-97)114-91-58-52-66(60-84(91)83-57-56-80-77-43-17-23-49-89(77)112(94(80)96(83)114)72-38-26-37-71(62-72)110-87-47-21-15-41-75(87)76-42-16-22-48-88(76)110)67-51-53-79-82-55-54-81-78-44-18-24-50-90(78)113(95(81)93(82)111(92(79)61-67)69-34-11-4-12-35-69)102-107-99(65-31-9-3-10-32-65)104-100(108-102)68-33-25-36-70(59-68)109-85-45-19-13-39-73(85)74-40-14-20-46-86(74)109/h1-21,23-47,49-62H,22,48H2.
What are the key properties of 3-[11-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazol-2-yl]-11-[3-(1,2-dihydrocarbazol-9-yl)phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole?
3-[11-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazol-2-yl]-11-[3-(1,2-dihydrocarbazol-9-yl)phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole has a molecular weight of 1457.72 g/mol, XLogP of 24.78, 11 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[11-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-12-phenylindolo[2,3-a]carbazol-2-yl]-11-[3-(1,2-dihydrocarbazol-9-yl)phenyl]-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole is sourced from PubChem (CID 170317164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).