2-carbazol-9-yl-9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-5-(9H-fluoren-9-yl)carbazole

C88H57N5 — CID 167381657

IUPAC2-carbazol-9-yl-9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-5-(9H-fluoren-9-yl)carbazole
SMILESc1ccc(-c2ccc(-c3nc(-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)nc(-c4cc(-c5ccccc5)c(-n5c6cc(-n7c8ccccc8c8ccccc87)ccc6c6c(C7c8ccccc8-c8ccccc87)cccc65)c(-c5ccccc5)c4)n3)cc2)cc1
InChIInChI=1S/C88H57N5/c1-6-25-57(26-7-1)60-45-47-63(48-46-60)86-89-87(66-52-64(58-27-8-2-9-28-58)51-65(53-66)59-29-10-3-11-30-59)91-88(90-86)67-54-77(61-31-12-4-13-32-61)85(78(55-67)62-33-14-5-15-34-62)93-81-44-24-41-76(83-73-39-18-16-35-69(73)70-36-17-19-40-74(70)83)84(81)75-50-49-68(56-82(75)93)92-79-42-22-20-37-71(79)72-38-21-23-43-80(72)92/h1-56,83H
InChIKeyRKASPLMPFCJIOD-UHFFFAOYSA-N
MW1184.46 g/mol
LogP22.56
Rot. Bonds11

About 2-carbazol-9-yl-9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-5-(9H-fluoren-9-yl)carbazole

2-carbazol-9-yl-9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-5-(9H-fluoren-9-yl)carbazole (PubChem CID 167381657) has the molecular formula C88H57N5 and a molecular weight of 1184.46 g/mol. Its IUPAC name is 2-carbazol-9-yl-9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-5-(9H-fluoren-9-yl)carbazole.

Molecular Properties

Compound Name2-carbazol-9-yl-9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-5-(9H-fluoren-9-yl)carbazole
PubChem CID167381657
Molecular FormulaC88H57N5
Molecular Weight1184.46 g/mol
Exact Mass1183.46
IUPAC Name2-carbazol-9-yl-9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-5-(9H-fluoren-9-yl)carbazole
SMILESc1ccc(-c2ccc(-c3nc(-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)nc(-c4cc(-c5ccccc5)c(-n5c6cc(-n7c8ccccc8c8ccccc87)ccc6c6c(C7c8ccccc8-c8ccccc87)cccc65)c(-c5ccccc5)c4)n3)cc2)cc1
InChIInChI=1S/C88H57N5/c1-6-25-57(26-7-1)60-45-47-63(48-46-60)86-89-87(66-52-64(58-27-8-2-9-28-58)51-65(53-66)59-29-10-3-11-30-59)91-88(90-86)67-54-77(61-31-12-4-13-32-61)85(78(55-67)62-33-14-5-15-34-62)93-81-44-24-41-76(83-73-39-18-16-35-69(73)70-36-17-19-40-74(70)83)84(81)75-50-49-68(56-82(75)93)92-79-42-22-20-37-71(79)72-38-21-23-43-80(72)92/h1-56,83H
InChIKeyRKASPLMPFCJIOD-UHFFFAOYSA-N
XLogP22.56
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms93
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001184.46
LogP ≤ 522.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-carbazol-9-yl-9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-5-(9H-fluoren-9-yl)carbazole with MolForge

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Related Compounds

2-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-diphenylphenyl]carbazole
CID 146280483
3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-bis(4-phenylphenyl)phenyl]-5-phenylcarbazole
CID 146280519
3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-diphenylphenyl]-6-(3-phenylphenyl)carbazole
CID 167381390
3-carbazol-9-yl-9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-6-phenylcarbazole
CID 146280568
6-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-15,24-diphenyl-6,15,24-triazaheptacyclo[14.11.0.02,14.05,13.07,12.017,25.018,23]heptacosa-1(16),2(14),3,5(13),7,9,11,17(25),18,20,22,26-dodecaene
CID 146280994
2-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-bis(4-phenylphenyl)phenyl]-6-phenylcarbazole;3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-bis(4-phenylphenyl)phenyl]-5-phenylcarbazole;2,7-di(carbazol-9-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-bis(4-phenylphenyl)phenyl]-3,6-diphenylcarbazole
CID 157299576
11-[4-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-5-phenylindolo[3,2-b]carbazole
CID 146280406
12-[2,6-diphenyl-4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-5-phenylindolo[3,2-c]carbazole
CID 146280424
12-[4-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-5-phenylindolo[3,2-c]carbazole
CID 146280664
2,7-di(carbazol-9-yl)-9-[4-(2,6-diphenylpyrimidin-4-yl)-2,6-diphenylphenyl]carbazole
CID 146280653
9-phenyl-4-[4-[4-phenyl-6-[4-[11-[4-[4-phenyl-6-[4-(9-phenylcarbazol-4-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole
CID 165151261
2-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-bis(4-phenylphenyl)phenyl]-6-(2,4,6-trimethylphenyl)carbazole
CID 146281302

Frequently Asked Questions

What is the IUPAC name of 2-carbazol-9-yl-9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-5-(9H-fluoren-9-yl)carbazole?
The IUPAC name of 2-carbazol-9-yl-9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-5-(9H-fluoren-9-yl)carbazole (CID 167381657) is 2-carbazol-9-yl-9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-5-(9H-fluoren-9-yl)carbazole.
What is the SMILES notation for 2-carbazol-9-yl-9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-5-(9H-fluoren-9-yl)carbazole?
The canonical SMILES for 2-carbazol-9-yl-9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-5-(9H-fluoren-9-yl)carbazole is c1ccc(-c2ccc(-c3nc(-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)nc(-c4cc(-c5ccccc5)c(-n5c6cc(-n7c8ccccc8c8ccccc87)ccc6c6c(C7c8ccccc8-c8ccccc87)cccc65)c(-c5ccccc5)c4)n3)cc2)cc1.
What is the InChIKey of 2-carbazol-9-yl-9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-5-(9H-fluoren-9-yl)carbazole?
The InChIKey is RKASPLMPFCJIOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C88H57N5/c1-6-25-57(26-7-1)60-45-47-63(48-46-60)86-89-87(66-52-64(58-27-8-2-9-28-58)51-65(53-66)59-29-10-3-11-30-59)91-88(90-86)67-54-77(61-31-12-4-13-32-61)85(78(55-67)62-33-14-5-15-34-62)93-81-44-24-41-76(83-73-39-18-16-35-69(73)70-36-17-19-40-74(70)83)84(81)75-50-49-68(56-82(75)93)92-79-42-22-20-37-71(79)72-38-21-23-43-80(72)92/h1-56,83H.
What are the key properties of 2-carbazol-9-yl-9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-5-(9H-fluoren-9-yl)carbazole?
2-carbazol-9-yl-9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-5-(9H-fluoren-9-yl)carbazole has a molecular weight of 1184.46 g/mol, XLogP of 22.56, 11 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-carbazol-9-yl-9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-5-(9H-fluoren-9-yl)carbazole is sourced from PubChem (CID 167381657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).