3-[6-[4-[4-[3-(8-dibenzofuran-1-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]-9-[4-[4-[3-[4-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-4-yl]-6-phenyldibenzothiophen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole

C162H95N13O4S — CID 137456997

IUPAC3-[6-[4-[4-[3-(8-dibenzofuran-1-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]-9-[4-[4-[3-[4-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-4-yl]-6-phenyldibenzothiophen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole
SMILESc1ccc(-c2nc(-c3ccc(-c4ccc(-c5cccc(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)c5)c5c4oc4ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccc(-c7nc(-c8ccccc8)nc(-c8cccc(-c9ccc(-c%10cccc%11c%10oc%10cccc(-c%12cccc(-c%13nc(-c%14ccccc%14)nc(-c%14ccccc%14)n%13)c%12)c%10%11)c%10sc%11c(-c%12ccccc%12)cccc%11c9%10)c8)n7)cc6)cc45)cc3)nc(-c3cccc(-c4cccc5oc6ccc(-c7cccc8oc9ccccc9c78)cc6c45)c3)n2)cc1
InChIInChI=1S/C162H95N13O4S/c1-8-35-96(36-9-1)124-62-30-65-130-146-122(83-85-127(150(146)180-149(124)130)126-63-31-64-129-143-118(59-34-70-141(143)179-147(126)129)108-49-26-53-113(89-108)159-167-151(98-37-10-2-11-38-98)163-152(168-159)99-39-12-3-13-40-99)111-52-29-56-116(92-111)162-172-156(103-47-20-7-21-48-103)166-158(174-162)105-75-80-117(81-76-105)175-134-66-24-22-57-125(134)131-93-106(77-86-135(131)175)107-78-87-138-133(94-107)145-121(110-51-28-55-115(91-110)160-169-153(100-41-14-4-15-42-100)164-154(170-160)101-43-16-5-17-44-101)82-84-123(148(145)178-138)97-71-73-104(74-72-97)157-165-155(102-45-18-6-19-46-102)171-161(173-157)114-54-27-50-109(90-114)119-60-32-69-140-144(119)132-95-112(79-88-137(132)177-140)120-61-33-68-139-142(120)128-58-23-25-67-136(128)176-139/h1-95H
InChIKeyFWCYMFPXHANJCL-UHFFFAOYSA-N
MW2319.70 g/mol
LogP42.50
Rot. Bonds22

About 3-[6-[4-[4-[3-(8-dibenzofuran-1-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]-9-[4-[4-[3-[4-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-4-yl]-6-phenyldibenzothiophen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole

3-[6-[4-[4-[3-(8-dibenzofuran-1-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]-9-[4-[4-[3-[4-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-4-yl]-6-phenyldibenzothiophen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole (PubChem CID 137456997) has the molecular formula C162H95N13O4S and a molecular weight of 2319.70 g/mol. Its IUPAC name is 3-[6-[4-[4-[3-(8-dibenzofuran-1-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]-9-[4-[4-[3-[4-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-4-yl]-6-phenyldibenzothiophen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole.

Molecular Properties

Compound Name3-[6-[4-[4-[3-(8-dibenzofuran-1-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]-9-[4-[4-[3-[4-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-4-yl]-6-phenyldibenzothiophen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole
PubChem CID137456997
Molecular FormulaC162H95N13O4S
Molecular Weight2319.70 g/mol
Exact Mass2317.74
IUPAC Name3-[6-[4-[4-[3-(8-dibenzofuran-1-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]-9-[4-[4-[3-[4-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-4-yl]-6-phenyldibenzothiophen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole
SMILESc1ccc(-c2nc(-c3ccc(-c4ccc(-c5cccc(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)c5)c5c4oc4ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccc(-c7nc(-c8ccccc8)nc(-c8cccc(-c9ccc(-c%10cccc%11c%10oc%10cccc(-c%12cccc(-c%13nc(-c%14ccccc%14)nc(-c%14ccccc%14)n%13)c%12)c%10%11)c%10sc%11c(-c%12ccccc%12)cccc%11c9%10)c8)n7)cc6)cc45)cc3)nc(-c3cccc(-c4cccc5oc6ccc(-c7cccc8oc9ccccc9c78)cc6c45)c3)n2)cc1
InChIInChI=1S/C162H95N13O4S/c1-8-35-96(36-9-1)124-62-30-65-130-146-122(83-85-127(150(146)180-149(124)130)126-63-31-64-129-143-118(59-34-70-141(143)179-147(126)129)108-49-26-53-113(89-108)159-167-151(98-37-10-2-11-38-98)163-152(168-159)99-39-12-3-13-40-99)111-52-29-56-116(92-111)162-172-156(103-47-20-7-21-48-103)166-158(174-162)105-75-80-117(81-76-105)175-134-66-24-22-57-125(134)131-93-106(77-86-135(131)175)107-78-87-138-133(94-107)145-121(110-51-28-55-115(91-110)160-169-153(100-41-14-4-15-42-100)164-154(170-160)101-43-16-5-17-44-101)82-84-123(148(145)178-138)97-71-73-104(74-72-97)157-165-155(102-45-18-6-19-46-102)171-161(173-157)114-54-27-50-109(90-114)119-60-32-69-140-144(119)132-95-112(79-88-137(132)177-140)120-61-33-68-139-142(120)128-58-23-25-67-136(128)176-139/h1-95H
InChIKeyFWCYMFPXHANJCL-UHFFFAOYSA-N
XLogP42.50
TPSA212.17 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds22
Heavy Atoms180
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002319.70
LogP ≤ 542.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 3-[6-[4-[4-[3-(8-dibenzofuran-1-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]-9-[4-[4-[3-[4-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-4-yl]-6-phenyldibenzothiophen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-[6-[4-[4-[3-(8-dibenzofuran-1-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]-9-[4-[4-[3-[4-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-4-yl]-6-phenyldibenzothiophen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole?
The IUPAC name of 3-[6-[4-[4-[3-(8-dibenzofuran-1-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]-9-[4-[4-[3-[4-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-4-yl]-6-phenyldibenzothiophen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole (CID 137456997) is 3-[6-[4-[4-[3-(8-dibenzofuran-1-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]-9-[4-[4-[3-[4-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-4-yl]-6-phenyldibenzothiophen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole.
What is the SMILES notation for 3-[6-[4-[4-[3-(8-dibenzofuran-1-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]-9-[4-[4-[3-[4-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-4-yl]-6-phenyldibenzothiophen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole?
The canonical SMILES for 3-[6-[4-[4-[3-(8-dibenzofuran-1-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]-9-[4-[4-[3-[4-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-4-yl]-6-phenyldibenzothiophen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole is c1ccc(-c2nc(-c3ccc(-c4ccc(-c5cccc(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)c5)c5c4oc4ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccc(-c7nc(-c8ccccc8)nc(-c8cccc(-c9ccc(-c%10cccc%11c%10oc%10cccc(-c%12cccc(-c%13nc(-c%14ccccc%14)nc(-c%14ccccc%14)n%13)c%12)c%10%11)c%10sc%11c(-c%12ccccc%12)cccc%11c9%10)c8)n7)cc6)cc45)cc3)nc(-c3cccc(-c4cccc5oc6ccc(-c7cccc8oc9ccccc9c78)cc6c45)c3)n2)cc1.
What is the InChIKey of 3-[6-[4-[4-[3-(8-dibenzofuran-1-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]-9-[4-[4-[3-[4-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-4-yl]-6-phenyldibenzothiophen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole?
The InChIKey is FWCYMFPXHANJCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C162H95N13O4S/c1-8-35-96(36-9-1)124-62-30-65-130-146-122(83-85-127(150(146)180-149(124)130)126-63-31-64-129-143-118(59-34-70-141(143)179-147(126)129)108-49-26-53-113(89-108)159-167-151(98-37-10-2-11-38-98)163-152(168-159)99-39-12-3-13-40-99)111-52-29-56-116(92-111)162-172-156(103-47-20-7-21-48-103)166-158(174-162)105-75-80-117(81-76-105)175-134-66-24-22-57-125(134)131-93-106(77-86-135(131)175)107-78-87-138-133(94-107)145-121(110-51-28-55-115(91-110)160-169-153(100-41-14-4-15-42-100)164-154(170-160)101-43-16-5-17-44-101)82-84-123(148(145)178-138)97-71-73-104(74-72-97)157-165-155(102-45-18-6-19-46-102)171-161(173-157)114-54-27-50-109(90-114)119-60-32-69-140-144(119)132-95-112(79-88-137(132)177-140)120-61-33-68-139-142(120)128-58-23-25-67-136(128)176-139/h1-95H.
What are the key properties of 3-[6-[4-[4-[3-(8-dibenzofuran-1-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]-9-[4-[4-[3-[4-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-4-yl]-6-phenyldibenzothiophen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole?
3-[6-[4-[4-[3-(8-dibenzofuran-1-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]-9-[4-[4-[3-[4-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-4-yl]-6-phenyldibenzothiophen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole has a molecular weight of 2319.70 g/mol, XLogP of 42.50, 22 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-[4-[4-[3-(8-dibenzofuran-1-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]-9-[4-[4-[3-[4-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-4-yl]-6-phenyldibenzothiophen-1-yl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole is sourced from PubChem (CID 137456997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).