2-carbazol-9-yl-7-[4-[3-[3-(3-carbazol-9-ylcarbazol-9-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,4-difluorophenyl]carbazol-9-yl]-9-[5-(2,6-difluorophenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole

C114H67F4N11 — CID 146414957

IUPAC2-carbazol-9-yl-7-[4-[3-[3-(3-carbazol-9-ylcarbazol-9-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,4-difluorophenyl]carbazol-9-yl]-9-[5-(2,6-difluorophenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
SMILESFc1cccc(F)c1-c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c(-n2c3cc(-n4c5ccccc5c5ccccc54)ccc3c3ccc(-n4c5ccccc5c5c(-c6ccc(F)c(-c7ccc(-c8nc(-c9ccccc9)nc(-c9ccccc9)n8)c(-n8c9ccccc9c9cc(-n%10c%11ccccc%11c%11ccccc%11%10)ccc98)c7)c6F)cccc54)cc32)c1
InChIInChI=1S/C114H67F4N11/c115-90-42-26-43-91(116)105(90)72-51-56-88(114-123-111(70-31-9-3-10-32-70)120-112(124-114)71-33-11-4-12-34-71)102(63-72)129-103-66-75(126-95-46-21-15-37-79(95)80-38-16-22-47-96(80)126)53-58-82(103)83-59-54-76(67-104(83)129)127-98-49-24-18-40-86(98)107-84(41-25-50-100(107)127)85-60-61-92(117)106(108(85)118)73-52-57-87(113-121-109(68-27-5-1-6-28-68)119-110(122-113)69-29-7-2-8-30-69)101(64-73)128-97-48-23-17-39-81(97)89-65-74(55-62-99(89)128)125-93-44-19-13-35-77(93)78-36-14-20-45-94(78)125/h1-67H
InChIKeyFZYRUQATGBOULZ-UHFFFAOYSA-N
MW1666.86 g/mol
LogP29.10
Rot. Bonds14

About 2-carbazol-9-yl-7-[4-[3-[3-(3-carbazol-9-ylcarbazol-9-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,4-difluorophenyl]carbazol-9-yl]-9-[5-(2,6-difluorophenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole

2-carbazol-9-yl-7-[4-[3-[3-(3-carbazol-9-ylcarbazol-9-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,4-difluorophenyl]carbazol-9-yl]-9-[5-(2,6-difluorophenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole (PubChem CID 146414957) has the molecular formula C114H67F4N11 and a molecular weight of 1666.86 g/mol. Its IUPAC name is 2-carbazol-9-yl-7-[4-[3-[3-(3-carbazol-9-ylcarbazol-9-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,4-difluorophenyl]carbazol-9-yl]-9-[5-(2,6-difluorophenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole.

Molecular Properties

Compound Name2-carbazol-9-yl-7-[4-[3-[3-(3-carbazol-9-ylcarbazol-9-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,4-difluorophenyl]carbazol-9-yl]-9-[5-(2,6-difluorophenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
PubChem CID146414957
Molecular FormulaC114H67F4N11
Molecular Weight1666.86 g/mol
Exact Mass1665.55
IUPAC Name2-carbazol-9-yl-7-[4-[3-[3-(3-carbazol-9-ylcarbazol-9-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,4-difluorophenyl]carbazol-9-yl]-9-[5-(2,6-difluorophenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
SMILESFc1cccc(F)c1-c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c(-n2c3cc(-n4c5ccccc5c5ccccc54)ccc3c3ccc(-n4c5ccccc5c5c(-c6ccc(F)c(-c7ccc(-c8nc(-c9ccccc9)nc(-c9ccccc9)n8)c(-n8c9ccccc9c9cc(-n%10c%11ccccc%11c%11ccccc%11%10)ccc98)c7)c6F)cccc54)cc32)c1
InChIInChI=1S/C114H67F4N11/c115-90-42-26-43-91(116)105(90)72-51-56-88(114-123-111(70-31-9-3-10-32-70)120-112(124-114)71-33-11-4-12-34-71)102(63-72)129-103-66-75(126-95-46-21-15-37-79(95)80-38-16-22-47-96(80)126)53-58-82(103)83-59-54-76(67-104(83)129)127-98-49-24-18-40-86(98)107-84(41-25-50-100(107)127)85-60-61-92(117)106(108(85)118)73-52-57-87(113-121-109(68-27-5-1-6-28-68)119-110(122-113)69-29-7-2-8-30-69)101(64-73)128-97-48-23-17-39-81(97)89-65-74(55-62-99(89)128)125-93-44-19-13-35-77(93)78-36-14-20-45-94(78)125/h1-67H
InChIKeyFZYRUQATGBOULZ-UHFFFAOYSA-N
XLogP29.10
TPSA101.99 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds14
Heavy Atoms129
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001666.86
LogP ≤ 529.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 2-carbazol-9-yl-7-[4-[3-[3-(3-carbazol-9-ylcarbazol-9-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,4-difluorophenyl]carbazol-9-yl]-9-[5-(2,6-difluorophenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole with MolForge

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Related Compounds

3,6-di(carbazol-9-yl)-9-[5-(2,6-difluorophenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 138566204
2,7-di(carbazol-9-yl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-(4-fluorophenyl)phenyl]carbazole
CID 138549500
4-(9-phenylcarbazol-4-yl)-9-[5-phenyl-2-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 174270072
9-[5-(2,6-difluorophenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,7-bis(3,5-dimethylphenyl)carbazole
CID 138566209
3-carbazol-9-yl-9-[5-(3,5-difluorophenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 138565341
3-benzo[c]carbazol-7-yl-5-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole
CID 155477032
2,7-di(carbazol-9-yl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(9-phenylcarbazol-4-yl)phenyl]carbazole
CID 155232653
2-carbazol-9-yl-4-[9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenylphenyl]carbazol-4-yl]-9-phenylcarbazole
CID 174271990
2-[3-(4-carbazol-9-ylcarbazol-9-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole
CID 174273630
4-(9-phenylcarbazol-4-yl)-9-[5-phenyl-2-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 174270121
3-[9-[9-[2-carbazol-9-yl-4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazol-2-yl]carbazol-3-yl]-9-phenylcarbazole;4-[9-[9-[2-carbazol-9-yl-5-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazol-3-yl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[2-carbazol-9-yl-5-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazol-2-yl]-9-(9-phenylcarbazol-3-yl)carbazole
CID 158305349
9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenylphenyl]-4-phenylcarbazole
CID 177099854

Frequently Asked Questions

What is the IUPAC name of 2-carbazol-9-yl-7-[4-[3-[3-(3-carbazol-9-ylcarbazol-9-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,4-difluorophenyl]carbazol-9-yl]-9-[5-(2,6-difluorophenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole?
The IUPAC name of 2-carbazol-9-yl-7-[4-[3-[3-(3-carbazol-9-ylcarbazol-9-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,4-difluorophenyl]carbazol-9-yl]-9-[5-(2,6-difluorophenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole (CID 146414957) is 2-carbazol-9-yl-7-[4-[3-[3-(3-carbazol-9-ylcarbazol-9-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,4-difluorophenyl]carbazol-9-yl]-9-[5-(2,6-difluorophenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole.
What is the SMILES notation for 2-carbazol-9-yl-7-[4-[3-[3-(3-carbazol-9-ylcarbazol-9-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,4-difluorophenyl]carbazol-9-yl]-9-[5-(2,6-difluorophenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole?
The canonical SMILES for 2-carbazol-9-yl-7-[4-[3-[3-(3-carbazol-9-ylcarbazol-9-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,4-difluorophenyl]carbazol-9-yl]-9-[5-(2,6-difluorophenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole is Fc1cccc(F)c1-c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c(-n2c3cc(-n4c5ccccc5c5ccccc54)ccc3c3ccc(-n4c5ccccc5c5c(-c6ccc(F)c(-c7ccc(-c8nc(-c9ccccc9)nc(-c9ccccc9)n8)c(-n8c9ccccc9c9cc(-n%10c%11ccccc%11c%11ccccc%11%10)ccc98)c7)c6F)cccc54)cc32)c1.
What is the InChIKey of 2-carbazol-9-yl-7-[4-[3-[3-(3-carbazol-9-ylcarbazol-9-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,4-difluorophenyl]carbazol-9-yl]-9-[5-(2,6-difluorophenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole?
The InChIKey is FZYRUQATGBOULZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C114H67F4N11/c115-90-42-26-43-91(116)105(90)72-51-56-88(114-123-111(70-31-9-3-10-32-70)120-112(124-114)71-33-11-4-12-34-71)102(63-72)129-103-66-75(126-95-46-21-15-37-79(95)80-38-16-22-47-96(80)126)53-58-82(103)83-59-54-76(67-104(83)129)127-98-49-24-18-40-86(98)107-84(41-25-50-100(107)127)85-60-61-92(117)106(108(85)118)73-52-57-87(113-121-109(68-27-5-1-6-28-68)119-110(122-113)69-29-7-2-8-30-69)101(64-73)128-97-48-23-17-39-81(97)89-65-74(55-62-99(89)128)125-93-44-19-13-35-77(93)78-36-14-20-45-94(78)125/h1-67H.
What are the key properties of 2-carbazol-9-yl-7-[4-[3-[3-(3-carbazol-9-ylcarbazol-9-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,4-difluorophenyl]carbazol-9-yl]-9-[5-(2,6-difluorophenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole?
2-carbazol-9-yl-7-[4-[3-[3-(3-carbazol-9-ylcarbazol-9-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,4-difluorophenyl]carbazol-9-yl]-9-[5-(2,6-difluorophenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole has a molecular weight of 1666.86 g/mol, XLogP of 29.10, 14 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 2-carbazol-9-yl-7-[4-[3-[3-(3-carbazol-9-ylcarbazol-9-yl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,4-difluorophenyl]carbazol-9-yl]-9-[5-(2,6-difluorophenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole is sourced from PubChem (CID 146414957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).