9-(2-carbazol-9-ylphenyl)-2-[2-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;9-(2-carbazol-9-ylphenyl)-2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole

C104H68N8 — CID 158054236

IUPAC9-(2-carbazol-9-ylphenyl)-2-[2-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;9-(2-carbazol-9-ylphenyl)-2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-c4ccc5c6ccccc6n(-c6ccccc6-n6c7ccccc7c7ccccc76)c5c4)c3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccccc3-c3ccc4c5ccccc5n(-c5ccccc5-n5c6ccccc6c6ccccc65)c4c3)n2)cc1
InChIInChI=1S/2C52H34N4/c1-3-16-35(17-4-1)44-34-45(36-18-5-2-6-19-36)54-52(53-44)39-21-15-20-37(32-39)38-30-31-43-42-24-9-12-27-48(42)56(51(43)33-38)50-29-14-13-28-49(50)55-46-25-10-7-22-40(46)41-23-8-11-26-47(41)55;1-3-17-35(18-4-1)44-34-45(36-19-5-2-6-20-36)54-52(53-44)43-25-8-7-21-38(43)37-31-32-42-41-24-11-14-28-48(41)56(51(42)33-37)50-30-16-15-29-49(50)55-46-26-12-9-22-39(46)40-23-10-13-27-47(40)55/h2*1-34H
InChIKeyFJVSKUHMFRUGBB-UHFFFAOYSA-N
MW1429.74 g/mol
LogP26.68
Rot. Bonds12

About 9-(2-carbazol-9-ylphenyl)-2-[2-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;9-(2-carbazol-9-ylphenyl)-2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole

9-(2-carbazol-9-ylphenyl)-2-[2-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;9-(2-carbazol-9-ylphenyl)-2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole (PubChem CID 158054236) has the molecular formula C104H68N8 and a molecular weight of 1429.74 g/mol. Its IUPAC name is 9-(2-carbazol-9-ylphenyl)-2-[2-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;9-(2-carbazol-9-ylphenyl)-2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole.

Molecular Properties

Compound Name9-(2-carbazol-9-ylphenyl)-2-[2-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;9-(2-carbazol-9-ylphenyl)-2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole
PubChem CID158054236
Molecular FormulaC104H68N8
Molecular Weight1429.74 g/mol
Exact Mass1428.56
IUPAC Name9-(2-carbazol-9-ylphenyl)-2-[2-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;9-(2-carbazol-9-ylphenyl)-2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-c4ccc5c6ccccc6n(-c6ccccc6-n6c7ccccc7c7ccccc76)c5c4)c3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccccc3-c3ccc4c5ccccc5n(-c5ccccc5-n5c6ccccc6c6ccccc65)c4c3)n2)cc1
InChIInChI=1S/2C52H34N4/c1-3-16-35(17-4-1)44-34-45(36-18-5-2-6-19-36)54-52(53-44)39-21-15-20-37(32-39)38-30-31-43-42-24-9-12-27-48(42)56(51(43)33-38)50-29-14-13-28-49(50)55-46-25-10-7-22-40(46)41-23-8-11-26-47(41)55;1-3-17-35(18-4-1)44-34-45(36-19-5-2-6-20-36)54-52(53-44)43-25-8-7-21-38(43)37-31-32-42-41-24-11-14-28-48(41)56(51(42)33-37)50-30-16-15-29-49(50)55-46-26-12-9-22-39(46)40-23-10-13-27-47(40)55/h2*1-34H
InChIKeyFJVSKUHMFRUGBB-UHFFFAOYSA-N
XLogP26.68
TPSA71.28 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds12
Heavy Atoms112
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001429.74
LogP ≤ 526.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 9-(2-carbazol-9-ylphenyl)-2-[2-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;9-(2-carbazol-9-ylphenyl)-2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole with MolForge

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Related Compounds

9-[4-carbazol-9-yl-6-[2-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,5-triazin-2-yl]-2-phenylcarbazole
CID 168742480
9-[2-[3-[3-[4-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 168801599
9-(3-carbazol-9-ylphenyl)-2-[3-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]carbazole
CID 90209079
9-[2-[2-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]carbazole
CID 153287600
9-[2-(3-phenylphenyl)-5-[4-(2-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 170659178
9-[2,4-bis(4,6-diphenylpyrimidin-2-yl)phenyl]-2-(2-methylphenyl)carbazole
CID 137421448
2-[3-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]phenyl]-9-(3-carbazol-9-ylphenyl)carbazole
CID 90209077
2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-9-[4-(9-phenylcarbazol-2-yl)phenyl]carbazole
CID 118149449
2-[4-(4,6-diphenylpyrimidin-2-yl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9-phenylcarbazole
CID 146648358
2-(2-phenylphenyl)-9-[3-[6-phenyl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]carbazole
CID 135143807
3-[9-[2-carbazol-9-yl-3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-2-yl]-9-phenylcarbazole;3-[9-[2-carbazol-9-yl-3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-9-phenylcarbazole
CID 160861807
9-[4-carbazol-9-yl-6-[2-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]-2-phenylcarbazole
CID 168742610

Frequently Asked Questions

What is the IUPAC name of 9-(2-carbazol-9-ylphenyl)-2-[2-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;9-(2-carbazol-9-ylphenyl)-2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole?
The IUPAC name of 9-(2-carbazol-9-ylphenyl)-2-[2-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;9-(2-carbazol-9-ylphenyl)-2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole (CID 158054236) is 9-(2-carbazol-9-ylphenyl)-2-[2-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;9-(2-carbazol-9-ylphenyl)-2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole.
What is the SMILES notation for 9-(2-carbazol-9-ylphenyl)-2-[2-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;9-(2-carbazol-9-ylphenyl)-2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole?
The canonical SMILES for 9-(2-carbazol-9-ylphenyl)-2-[2-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;9-(2-carbazol-9-ylphenyl)-2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole is c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-c4ccc5c6ccccc6n(-c6ccccc6-n6c7ccccc7c7ccccc76)c5c4)c3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccccc3-c3ccc4c5ccccc5n(-c5ccccc5-n5c6ccccc6c6ccccc65)c4c3)n2)cc1.
What is the InChIKey of 9-(2-carbazol-9-ylphenyl)-2-[2-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;9-(2-carbazol-9-ylphenyl)-2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole?
The InChIKey is FJVSKUHMFRUGBB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C52H34N4/c1-3-16-35(17-4-1)44-34-45(36-18-5-2-6-19-36)54-52(53-44)39-21-15-20-37(32-39)38-30-31-43-42-24-9-12-27-48(42)56(51(43)33-38)50-29-14-13-28-49(50)55-46-25-10-7-22-40(46)41-23-8-11-26-47(41)55;1-3-17-35(18-4-1)44-34-45(36-19-5-2-6-20-36)54-52(53-44)43-25-8-7-21-38(43)37-31-32-42-41-24-11-14-28-48(41)56(51(42)33-37)50-30-16-15-29-49(50)55-46-26-12-9-22-39(46)40-23-10-13-27-47(40)55/h2*1-34H.
What are the key properties of 9-(2-carbazol-9-ylphenyl)-2-[2-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;9-(2-carbazol-9-ylphenyl)-2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole?
9-(2-carbazol-9-ylphenyl)-2-[2-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;9-(2-carbazol-9-ylphenyl)-2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole has a molecular weight of 1429.74 g/mol, XLogP of 26.68, 12 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2-carbazol-9-ylphenyl)-2-[2-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;9-(2-carbazol-9-ylphenyl)-2-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole is sourced from PubChem (CID 158054236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).