5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[8-[5-[4-[3-[4-[3-[8-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-3-yl]dibenzofuran-2-yl]-5-(4-ethyl-6-phenyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]phenyl]-6-ethyl-1,3,5-triazin-2-yl]-9-phenylcarbazol-3-yl]dibenzothiophen-2-yl]-9-phenylcarbazole

C148H94N16OS — CID 139429386

IUPAC5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[8-[5-[4-[3-[4-[3-[8-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-3-yl]dibenzofuran-2-yl]-5-(4-ethyl-6-phenyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]phenyl]-6-ethyl-1,3,5-triazin-2-yl]-9-phenylcarbazol-3-yl]dibenzothiophen-2-yl]-9-phenylcarbazole
SMILESCCc1nc(-c2ccccc2)nc(-c2cccc3c2c2cc(-c4ccc5oc6ccc(-c7ccc8c(c7)c7c(-c9nc(-c%10ccccc%10)nc(-c%10ccccc%10)n9)cccc7n8-c7ccccc7)cc6c5c4)ccc2n3-c2ccc(-c3cccc(-c4nc(CC)nc(-c5cccc6c5c5cc(-c7ccc8sc9ccc(-c%10ccc%11c(c%10)c%10c(-c%12nc(-c%13ccccc%13)nc(-c%13ccccc%13)n%12)cccc%10n%11-c%10ccccc%10)cc9c8c7)ccc5n6-c5ccccc5)n4)c3)cc2)n1
InChIInChI=1S/C148H94N16OS/c1-3-133-149-139(90-34-13-5-14-35-90)155-145(151-133)109-52-31-59-128-136(109)120-86-97(101-67-77-130-114(82-101)113-81-100(66-76-129(113)165-130)96-62-72-122-118(85-96)137-111(54-32-57-126(137)162(122)106-48-25-11-26-49-106)147-156-140(91-36-15-6-16-37-91)153-141(157-147)92-38-17-7-18-39-92)63-75-124(120)164(128)108-70-60-89(61-71-108)95-44-29-45-104(80-95)144-150-134(4-2)152-146(160-144)110-53-30-56-125-135(110)117-87-98(64-73-121(117)161(125)105-46-23-10-24-47-105)102-68-78-131-115(83-102)116-84-103(69-79-132(116)166-131)99-65-74-123-119(88-99)138-112(55-33-58-127(138)163(123)107-50-27-12-28-51-107)148-158-142(93-40-19-8-20-41-93)154-143(159-148)94-42-21-9-22-43-94/h5-88H,3-4H2,1-2H3
InChIKeyGIUTWAKJJAQWBU-UHFFFAOYSA-N
MW2144.56 g/mol
LogP37.21
Rot. Bonds21

About 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[8-[5-[4-[3-[4-[3-[8-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-3-yl]dibenzofuran-2-yl]-5-(4-ethyl-6-phenyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]phenyl]-6-ethyl-1,3,5-triazin-2-yl]-9-phenylcarbazol-3-yl]dibenzothiophen-2-yl]-9-phenylcarbazole

5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[8-[5-[4-[3-[4-[3-[8-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-3-yl]dibenzofuran-2-yl]-5-(4-ethyl-6-phenyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]phenyl]-6-ethyl-1,3,5-triazin-2-yl]-9-phenylcarbazol-3-yl]dibenzothiophen-2-yl]-9-phenylcarbazole (PubChem CID 139429386) has the molecular formula C148H94N16OS and a molecular weight of 2144.56 g/mol. Its IUPAC name is 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[8-[5-[4-[3-[4-[3-[8-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-3-yl]dibenzofuran-2-yl]-5-(4-ethyl-6-phenyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]phenyl]-6-ethyl-1,3,5-triazin-2-yl]-9-phenylcarbazol-3-yl]dibenzothiophen-2-yl]-9-phenylcarbazole.

Molecular Properties

Compound Name5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[8-[5-[4-[3-[4-[3-[8-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-3-yl]dibenzofuran-2-yl]-5-(4-ethyl-6-phenyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]phenyl]-6-ethyl-1,3,5-triazin-2-yl]-9-phenylcarbazol-3-yl]dibenzothiophen-2-yl]-9-phenylcarbazole
PubChem CID139429386
Molecular FormulaC148H94N16OS
Molecular Weight2144.56 g/mol
Exact Mass2142.75
IUPAC Name5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[8-[5-[4-[3-[4-[3-[8-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-3-yl]dibenzofuran-2-yl]-5-(4-ethyl-6-phenyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]phenyl]-6-ethyl-1,3,5-triazin-2-yl]-9-phenylcarbazol-3-yl]dibenzothiophen-2-yl]-9-phenylcarbazole
SMILESCCc1nc(-c2ccccc2)nc(-c2cccc3c2c2cc(-c4ccc5oc6ccc(-c7ccc8c(c7)c7c(-c9nc(-c%10ccccc%10)nc(-c%10ccccc%10)n9)cccc7n8-c7ccccc7)cc6c5c4)ccc2n3-c2ccc(-c3cccc(-c4nc(CC)nc(-c5cccc6c5c5cc(-c7ccc8sc9ccc(-c%10ccc%11c(c%10)c%10c(-c%12nc(-c%13ccccc%13)nc(-c%13ccccc%13)n%12)cccc%10n%11-c%10ccccc%10)cc9c8c7)ccc5n6-c5ccccc5)n4)c3)cc2)n1
InChIInChI=1S/C148H94N16OS/c1-3-133-149-139(90-34-13-5-14-35-90)155-145(151-133)109-52-31-59-128-136(109)120-86-97(101-67-77-130-114(82-101)113-81-100(66-76-129(113)165-130)96-62-72-122-118(85-96)137-111(54-32-57-126(137)162(122)106-48-25-11-26-49-106)147-156-140(91-36-15-6-16-37-91)153-141(157-147)92-38-17-7-18-39-92)63-75-124(120)164(128)108-70-60-89(61-71-108)95-44-29-45-104(80-95)144-150-134(4-2)152-146(160-144)110-53-30-56-125-135(110)117-87-98(64-73-121(117)161(125)105-46-23-10-24-47-105)102-68-78-131-115(83-102)116-84-103(69-79-132(116)166-131)99-65-74-123-119(88-99)138-112(55-33-58-127(138)163(123)107-50-27-12-28-51-107)148-158-142(93-40-19-8-20-41-93)154-143(159-148)94-42-21-9-22-43-94/h5-88H,3-4H2,1-2H3
InChIKeyGIUTWAKJJAQWBU-UHFFFAOYSA-N
XLogP37.21
TPSA187.54 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds21
Heavy Atoms166
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002144.56
LogP ≤ 537.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[8-[5-[4-[3-[4-[3-[8-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-3-yl]dibenzofuran-2-yl]-5-(4-ethyl-6-phenyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]phenyl]-6-ethyl-1,3,5-triazin-2-yl]-9-phenylcarbazol-3-yl]dibenzothiophen-2-yl]-9-phenylcarbazole with MolForge

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Related Compounds

3-[4-[4-([1]Benzofuro[2,3-a]carbazol-12-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;3-[3-[4-([1]benzofuro[2,3-a]carbazol-12-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]benzonitrile;4-[4-[4-([1]benzothiolo[2,3-a]carbazol-12-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;4-[3-[4-([1]benzothiolo[2,3-a]carbazol-12-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]benzonitrile
CID 160780170
6-Dibenzofuran-3-yl-12-phenyl-[1]benzothiolo[2,3-a]carbazole;6-[9-(2,6-diphenylpyrimidin-4-yl)carbazol-3-yl]-12-phenyl-[1]benzothiolo[2,3-a]carbazole;6-[9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-3-yl]-12-naphthalen-2-yl-[1]benzothiolo[2,3-a]carbazole
CID 160780233
2-Dibenzofuran-4-yl-9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-phenylindolo[2,3-a]carbazole;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-(3-isocyanophenyl)indolo[2,3-b]carbazole;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenyl-[1]benzothiolo[3,2-c]carbazole
CID 163563948
CID 163643732
CID 163643732
12-[6-(4-Dibenzothiophen-3-yl-6-dibenzothiophen-4-yl-1,3,5-triazin-2-yl)naphtho[2,1-b][1]benzofuran-2-yl]-7-[12-[6-(4-dibenzothiophen-3-yl-6-dibenzothiophen-4-yl-1,3,5-triazin-2-yl)naphtho[2,1-b][1]benzofuran-3-yl]-12-azapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14(19),15,17,20-decaen-18-yl]-12-azapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
CID 163644582
2-Dibenzofuran-4-yl-12-[4-(4,6-diphenyl-1,3-diaza-5-azanidacyclohexa-2,6-dien-2-yl)phenyl]-[1]benzothiolo[3,2-a]carbazole
CID 163644785
9-[9-[6-(4,6-Diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-3-yl]dibenzofuran-2-yl]carbazole
CID 163645111
3-[6-[4-[3-[9-[6-(4,6-Diphenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]carbazol-3-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-9-[3-[3-[4-phenyl-6-[7-(9-phenylcarbazol-3-yl)dibenzothiophen-4-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]carbazole
CID 163645754
2-[4-Dibenzofuran-1-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-7-phenyl-[1]benzofuro[2,3-b]carbazole;2-[4-dibenzofuran-3-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-7-phenyl-[1]benzofuro[2,3-b]carbazole;2-[4-dibenzofuran-3-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-7-phenyl-[1]benzofuro[2,3-b]carbazole;2-[4-dibenzothiophen-1-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-7-phenyl-[1]benzofuro[2,3-b]carbazole;2-[4-dibenzothiophen-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-7-phenyl-[1]benzofuro[2,3-b]carbazole;2-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-7-phenyl-[1]benzofuro[2,3-b]carbazole
CID 163645908
2-(4-Dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-7-phenyl-[1]benzofuro[2,3-b]carbazole
CID 163645909
2-[4-Dibenzothiophen-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-7-phenyl-[1]benzofuro[2,3-b]carbazole
CID 163645913
2-[4-Dibenzothiophen-1-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-7-phenyl-[1]benzofuro[2,3-b]carbazole
CID 163645914

Frequently Asked Questions

What is the IUPAC name of 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[8-[5-[4-[3-[4-[3-[8-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-3-yl]dibenzofuran-2-yl]-5-(4-ethyl-6-phenyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]phenyl]-6-ethyl-1,3,5-triazin-2-yl]-9-phenylcarbazol-3-yl]dibenzothiophen-2-yl]-9-phenylcarbazole?
The IUPAC name of 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[8-[5-[4-[3-[4-[3-[8-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-3-yl]dibenzofuran-2-yl]-5-(4-ethyl-6-phenyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]phenyl]-6-ethyl-1,3,5-triazin-2-yl]-9-phenylcarbazol-3-yl]dibenzothiophen-2-yl]-9-phenylcarbazole (CID 139429386) is 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[8-[5-[4-[3-[4-[3-[8-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-3-yl]dibenzofuran-2-yl]-5-(4-ethyl-6-phenyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]phenyl]-6-ethyl-1,3,5-triazin-2-yl]-9-phenylcarbazol-3-yl]dibenzothiophen-2-yl]-9-phenylcarbazole.
What is the SMILES notation for 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[8-[5-[4-[3-[4-[3-[8-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-3-yl]dibenzofuran-2-yl]-5-(4-ethyl-6-phenyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]phenyl]-6-ethyl-1,3,5-triazin-2-yl]-9-phenylcarbazol-3-yl]dibenzothiophen-2-yl]-9-phenylcarbazole?
The canonical SMILES for 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[8-[5-[4-[3-[4-[3-[8-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-3-yl]dibenzofuran-2-yl]-5-(4-ethyl-6-phenyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]phenyl]-6-ethyl-1,3,5-triazin-2-yl]-9-phenylcarbazol-3-yl]dibenzothiophen-2-yl]-9-phenylcarbazole is CCc1nc(-c2ccccc2)nc(-c2cccc3c2c2cc(-c4ccc5oc6ccc(-c7ccc8c(c7)c7c(-c9nc(-c%10ccccc%10)nc(-c%10ccccc%10)n9)cccc7n8-c7ccccc7)cc6c5c4)ccc2n3-c2ccc(-c3cccc(-c4nc(CC)nc(-c5cccc6c5c5cc(-c7ccc8sc9ccc(-c%10ccc%11c(c%10)c%10c(-c%12nc(-c%13ccccc%13)nc(-c%13ccccc%13)n%12)cccc%10n%11-c%10ccccc%10)cc9c8c7)ccc5n6-c5ccccc5)n4)c3)cc2)n1.
What is the InChIKey of 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[8-[5-[4-[3-[4-[3-[8-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-3-yl]dibenzofuran-2-yl]-5-(4-ethyl-6-phenyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]phenyl]-6-ethyl-1,3,5-triazin-2-yl]-9-phenylcarbazol-3-yl]dibenzothiophen-2-yl]-9-phenylcarbazole?
The InChIKey is GIUTWAKJJAQWBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C148H94N16OS/c1-3-133-149-139(90-34-13-5-14-35-90)155-145(151-133)109-52-31-59-128-136(109)120-86-97(101-67-77-130-114(82-101)113-81-100(66-76-129(113)165-130)96-62-72-122-118(85-96)137-111(54-32-57-126(137)162(122)106-48-25-11-26-49-106)147-156-140(91-36-15-6-16-37-91)153-141(157-147)92-38-17-7-18-39-92)63-75-124(120)164(128)108-70-60-89(61-71-108)95-44-29-45-104(80-95)144-150-134(4-2)152-146(160-144)110-53-30-56-125-135(110)117-87-98(64-73-121(117)161(125)105-46-23-10-24-47-105)102-68-78-131-115(83-102)116-84-103(69-79-132(116)166-131)99-65-74-123-119(88-99)138-112(55-33-58-127(138)163(123)107-50-27-12-28-51-107)148-158-142(93-40-19-8-20-41-93)154-143(159-148)94-42-21-9-22-43-94/h5-88H,3-4H2,1-2H3.
What are the key properties of 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[8-[5-[4-[3-[4-[3-[8-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-3-yl]dibenzofuran-2-yl]-5-(4-ethyl-6-phenyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]phenyl]-6-ethyl-1,3,5-triazin-2-yl]-9-phenylcarbazol-3-yl]dibenzothiophen-2-yl]-9-phenylcarbazole?
5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[8-[5-[4-[3-[4-[3-[8-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-3-yl]dibenzofuran-2-yl]-5-(4-ethyl-6-phenyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]phenyl]-6-ethyl-1,3,5-triazin-2-yl]-9-phenylcarbazol-3-yl]dibenzothiophen-2-yl]-9-phenylcarbazole has a molecular weight of 2144.56 g/mol, XLogP of 37.21, 21 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-[8-[5-[4-[3-[4-[3-[8-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-3-yl]dibenzofuran-2-yl]-5-(4-ethyl-6-phenyl-1,3,5-triazin-2-yl)carbazol-9-yl]phenyl]phenyl]-6-ethyl-1,3,5-triazin-2-yl]-9-phenylcarbazol-3-yl]dibenzothiophen-2-yl]-9-phenylcarbazole is sourced from PubChem (CID 139429386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).