3-[9-(4,6-dipyridin-2-yl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-[9-[6-[4-[3-[9-[9-[6-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzofuran-4-yl]carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzothiophen-4-yl]carbazole

C147H85N21OS — CID 139393043

IUPAC3-[9-(4,6-dipyridin-2-yl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-[9-[6-[4-[3-[9-[9-[6-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzofuran-4-yl]carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzothiophen-4-yl]carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5nc(-c6ccccn6)nc(-c6cccc(-c7cccc8oc9c(-n%10c%11ccccc%11c%11cc(-c%12ccc%13c(c%12)c%12ccccc%12n%13-c%12nc(-c%13ccccn%13)nc(-c%13cccc(-c%14cccc%15sc%16c(-n%17c%18ccccc%18c%18cc(-c%19ccc%20c(c%19)c%19ccccc%19n%20-c%19nc(-c%20ccccn%20)nc(-c%20ccccn%20)n%19)ccc%18%17)cccc%16c%14%15)n%13)n%12)ccc%11%10)cccc9c78)n6)n5)ccc43)cc2)cc1
InChIInChI=1S/C147H85N21OS/c1-2-30-86(31-3-1)87-60-68-94(69-61-87)163-119-50-10-4-32-95(119)105-80-88(62-70-125(105)163)91-65-74-129-109(83-91)99-36-8-14-54-123(99)167(129)146-159-141(115-44-18-22-78-150-115)155-143(161-146)117-48-28-46-111(152-117)101-38-26-58-133-135(101)103-40-24-56-131(137(103)169-133)164-120-51-11-5-33-96(120)106-81-89(63-71-126(106)164)92-67-75-130-110(84-92)100-37-9-15-55-124(100)168(130)147-160-142(116-45-19-23-79-151-116)156-144(162-147)118-49-29-47-112(153-118)102-39-27-59-134-136(102)104-41-25-57-132(138(104)170-134)165-121-52-12-6-34-97(121)107-82-90(64-72-127(107)165)93-66-73-128-108(85-93)98-35-7-13-53-122(98)166(128)145-157-139(113-42-16-20-76-148-113)154-140(158-145)114-43-17-21-77-149-114/h1-85H
InChIKeyZNQVRZSBIOJOAP-UHFFFAOYSA-N
MW2193.51 g/mol
LogP35.47
Rot. Bonds18

About 3-[9-(4,6-dipyridin-2-yl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-[9-[6-[4-[3-[9-[9-[6-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzofuran-4-yl]carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzothiophen-4-yl]carbazole

3-[9-(4,6-dipyridin-2-yl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-[9-[6-[4-[3-[9-[9-[6-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzofuran-4-yl]carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzothiophen-4-yl]carbazole (PubChem CID 139393043) has the molecular formula C147H85N21OS and a molecular weight of 2193.51 g/mol. Its IUPAC name is 3-[9-(4,6-dipyridin-2-yl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-[9-[6-[4-[3-[9-[9-[6-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzofuran-4-yl]carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzothiophen-4-yl]carbazole.

Molecular Properties

Compound Name3-[9-(4,6-dipyridin-2-yl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-[9-[6-[4-[3-[9-[9-[6-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzofuran-4-yl]carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzothiophen-4-yl]carbazole
PubChem CID139393043
Molecular FormulaC147H85N21OS
Molecular Weight2193.51 g/mol
Exact Mass2191.70
IUPAC Name3-[9-(4,6-dipyridin-2-yl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-[9-[6-[4-[3-[9-[9-[6-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzofuran-4-yl]carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzothiophen-4-yl]carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5nc(-c6ccccn6)nc(-c6cccc(-c7cccc8oc9c(-n%10c%11ccccc%11c%11cc(-c%12ccc%13c(c%12)c%12ccccc%12n%13-c%12nc(-c%13ccccn%13)nc(-c%13cccc(-c%14cccc%15sc%16c(-n%17c%18ccccc%18c%18cc(-c%19ccc%20c(c%19)c%19ccccc%19n%20-c%19nc(-c%20ccccn%20)nc(-c%20ccccn%20)n%19)ccc%18%17)cccc%16c%14%15)n%13)n%12)ccc%11%10)cccc9c78)n6)n5)ccc43)cc2)cc1
InChIInChI=1S/C147H85N21OS/c1-2-30-86(31-3-1)87-60-68-94(69-61-87)163-119-50-10-4-32-95(119)105-80-88(62-70-125(105)163)91-65-74-129-109(83-91)99-36-8-14-54-123(99)167(129)146-159-141(115-44-18-22-78-150-115)155-143(161-146)117-48-28-46-111(152-117)101-38-26-58-133-135(101)103-40-24-56-131(137(103)169-133)164-120-51-11-5-33-96(120)106-81-89(63-71-126(106)164)92-67-75-130-110(84-92)100-37-9-15-55-124(100)168(130)147-160-142(116-45-19-23-79-151-116)156-144(162-147)118-49-29-47-112(153-118)102-39-27-59-134-136(102)104-41-25-57-132(138(104)170-134)165-121-52-12-6-34-97(121)107-82-90(64-72-127(107)165)93-66-73-128-108(85-93)98-35-7-13-53-122(98)166(128)145-157-139(113-42-16-20-76-148-113)154-140(158-145)114-43-17-21-77-149-114/h1-85H
InChIKeyZNQVRZSBIOJOAP-UHFFFAOYSA-N
XLogP35.47
TPSA236.07 Ų
H-Bond Donors
H-Bond Acceptors23
Rotatable Bonds18
Heavy Atoms170
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002193.51
LogP ≤ 535.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1023

Analyze 3-[9-(4,6-dipyridin-2-yl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-[9-[6-[4-[3-[9-[9-[6-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzofuran-4-yl]carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzothiophen-4-yl]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-[9-(4,6-dipyridin-2-yl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-[9-[6-[4-[3-[9-[9-[6-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzofuran-4-yl]carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzothiophen-4-yl]carbazole?
The IUPAC name of 3-[9-(4,6-dipyridin-2-yl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-[9-[6-[4-[3-[9-[9-[6-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzofuran-4-yl]carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzothiophen-4-yl]carbazole (CID 139393043) is 3-[9-(4,6-dipyridin-2-yl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-[9-[6-[4-[3-[9-[9-[6-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzofuran-4-yl]carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzothiophen-4-yl]carbazole.
What is the SMILES notation for 3-[9-(4,6-dipyridin-2-yl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-[9-[6-[4-[3-[9-[9-[6-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzofuran-4-yl]carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzothiophen-4-yl]carbazole?
The canonical SMILES for 3-[9-(4,6-dipyridin-2-yl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-[9-[6-[4-[3-[9-[9-[6-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzofuran-4-yl]carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzothiophen-4-yl]carbazole is c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5nc(-c6ccccn6)nc(-c6cccc(-c7cccc8oc9c(-n%10c%11ccccc%11c%11cc(-c%12ccc%13c(c%12)c%12ccccc%12n%13-c%12nc(-c%13ccccn%13)nc(-c%13cccc(-c%14cccc%15sc%16c(-n%17c%18ccccc%18c%18cc(-c%19ccc%20c(c%19)c%19ccccc%19n%20-c%19nc(-c%20ccccn%20)nc(-c%20ccccn%20)n%19)ccc%18%17)cccc%16c%14%15)n%13)n%12)ccc%11%10)cccc9c78)n6)n5)ccc43)cc2)cc1.
What is the InChIKey of 3-[9-(4,6-dipyridin-2-yl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-[9-[6-[4-[3-[9-[9-[6-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzofuran-4-yl]carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzothiophen-4-yl]carbazole?
The InChIKey is ZNQVRZSBIOJOAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C147H85N21OS/c1-2-30-86(31-3-1)87-60-68-94(69-61-87)163-119-50-10-4-32-95(119)105-80-88(62-70-125(105)163)91-65-74-129-109(83-91)99-36-8-14-54-123(99)167(129)146-159-141(115-44-18-22-78-150-115)155-143(161-146)117-48-28-46-111(152-117)101-38-26-58-133-135(101)103-40-24-56-131(137(103)169-133)164-120-51-11-5-33-96(120)106-81-89(63-71-126(106)164)92-67-75-130-110(84-92)100-37-9-15-55-124(100)168(130)147-160-142(116-45-19-23-79-151-116)156-144(162-147)118-49-29-47-112(153-118)102-39-27-59-134-136(102)104-41-25-57-132(138(104)170-134)165-121-52-12-6-34-97(121)107-82-90(64-72-127(107)165)93-66-73-128-108(85-93)98-35-7-13-53-122(98)166(128)145-157-139(113-42-16-20-76-148-113)154-140(158-145)114-43-17-21-77-149-114/h1-85H.
What are the key properties of 3-[9-(4,6-dipyridin-2-yl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-[9-[6-[4-[3-[9-[9-[6-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzofuran-4-yl]carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzothiophen-4-yl]carbazole?
3-[9-(4,6-dipyridin-2-yl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-[9-[6-[4-[3-[9-[9-[6-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzofuran-4-yl]carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzothiophen-4-yl]carbazole has a molecular weight of 2193.51 g/mol, XLogP of 35.47, 18 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[9-(4,6-dipyridin-2-yl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-[9-[6-[4-[3-[9-[9-[6-[4-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzofuran-4-yl]carbazol-3-yl]carbazol-9-yl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzothiophen-4-yl]carbazole is sourced from PubChem (CID 139393043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).