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

C84H54N8 — CID 137397297

IUPAC1-phenyl-9-[4-phenyl-6-[3-[2-[3-[3-[4-phenyl-6-[1-(4-phenylphenyl)carbazol-9-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole
SMILESc1ccc(-c2ccc(-c3cccc4c5ccccc5n(-c5nc(-c6ccccc6)nc(-c6cccc(-c7cccc(-c8ccccc8-c8cccc(-c9nc(-c%10ccccc%10)nc(-n%10c%11ccccc%11c%11cccc(-c%12ccccc%12)c%11%10)n9)c8)c7)c6)n5)c34)cc2)cc1
InChIInChI=1S/C84H54N8/c1-5-24-55(25-6-1)56-48-50-58(51-49-56)70-43-23-45-74-72-41-16-18-47-76(72)92(78(70)74)83-87-79(59-28-9-3-10-29-59)85-81(89-83)65-36-20-33-62(53-65)61-32-19-34-63(52-61)67-38-13-14-39-68(67)64-35-21-37-66(54-64)82-86-80(60-30-11-4-12-31-60)88-84(90-82)91-75-46-17-15-40-71(75)73-44-22-42-69(77(73)91)57-26-7-2-8-27-57/h1-54H
InChIKeyYYRDNXLIPZONOE-UHFFFAOYSA-N
MW1175.41 g/mol
LogP20.92
Rot. Bonds12

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

1-phenyl-9-[4-phenyl-6-[3-[2-[3-[3-[4-phenyl-6-[1-(4-phenylphenyl)carbazol-9-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole (PubChem CID 137397297) has the molecular formula C84H54N8 and a molecular weight of 1175.41 g/mol. Its IUPAC name is 1-phenyl-9-[4-phenyl-6-[3-[2-[3-[3-[4-phenyl-6-[1-(4-phenylphenyl)carbazol-9-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole.

Molecular Properties

Compound Name1-phenyl-9-[4-phenyl-6-[3-[2-[3-[3-[4-phenyl-6-[1-(4-phenylphenyl)carbazol-9-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole
PubChem CID137397297
Molecular FormulaC84H54N8
Molecular Weight1175.41 g/mol
Exact Mass1174.45
IUPAC Name1-phenyl-9-[4-phenyl-6-[3-[2-[3-[3-[4-phenyl-6-[1-(4-phenylphenyl)carbazol-9-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole
SMILESc1ccc(-c2ccc(-c3cccc4c5ccccc5n(-c5nc(-c6ccccc6)nc(-c6cccc(-c7cccc(-c8ccccc8-c8cccc(-c9nc(-c%10ccccc%10)nc(-n%10c%11ccccc%11c%11cccc(-c%12ccccc%12)c%11%10)n9)c8)c7)c6)n5)c34)cc2)cc1
InChIInChI=1S/C84H54N8/c1-5-24-55(25-6-1)56-48-50-58(51-49-56)70-43-23-45-74-72-41-16-18-47-76(72)92(78(70)74)83-87-79(59-28-9-3-10-29-59)85-81(89-83)65-36-20-33-62(53-65)61-32-19-34-63(52-61)67-38-13-14-39-68(67)64-35-21-37-66(54-64)82-86-80(60-30-11-4-12-31-60)88-84(90-82)91-75-46-17-15-40-71(75)73-44-22-42-69(77(73)91)57-26-7-2-8-27-57/h1-54H
InChIKeyYYRDNXLIPZONOE-UHFFFAOYSA-N
XLogP20.92
TPSA87.20 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds12
Heavy Atoms92
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001175.41
LogP ≤ 520.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-9-[4-phenyl-6-[3-[2-[3-[3-[4-phenyl-6-[1-(4-phenylphenyl)carbazol-9-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole?
The IUPAC name of 1-phenyl-9-[4-phenyl-6-[3-[2-[3-[3-[4-phenyl-6-[1-(4-phenylphenyl)carbazol-9-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole (CID 137397297) is 1-phenyl-9-[4-phenyl-6-[3-[2-[3-[3-[4-phenyl-6-[1-(4-phenylphenyl)carbazol-9-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole.
What is the SMILES notation for 1-phenyl-9-[4-phenyl-6-[3-[2-[3-[3-[4-phenyl-6-[1-(4-phenylphenyl)carbazol-9-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole?
The canonical SMILES for 1-phenyl-9-[4-phenyl-6-[3-[2-[3-[3-[4-phenyl-6-[1-(4-phenylphenyl)carbazol-9-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole is c1ccc(-c2ccc(-c3cccc4c5ccccc5n(-c5nc(-c6ccccc6)nc(-c6cccc(-c7cccc(-c8ccccc8-c8cccc(-c9nc(-c%10ccccc%10)nc(-n%10c%11ccccc%11c%11cccc(-c%12ccccc%12)c%11%10)n9)c8)c7)c6)n5)c34)cc2)cc1.
What is the InChIKey of 1-phenyl-9-[4-phenyl-6-[3-[2-[3-[3-[4-phenyl-6-[1-(4-phenylphenyl)carbazol-9-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole?
The InChIKey is YYRDNXLIPZONOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C84H54N8/c1-5-24-55(25-6-1)56-48-50-58(51-49-56)70-43-23-45-74-72-41-16-18-47-76(72)92(78(70)74)83-87-79(59-28-9-3-10-29-59)85-81(89-83)65-36-20-33-62(53-65)61-32-19-34-63(52-61)67-38-13-14-39-68(67)64-35-21-37-66(54-64)82-86-80(60-30-11-4-12-31-60)88-84(90-82)91-75-46-17-15-40-71(75)73-44-22-42-69(77(73)91)57-26-7-2-8-27-57/h1-54H.
What are the key properties of 1-phenyl-9-[4-phenyl-6-[3-[2-[3-[3-[4-phenyl-6-[1-(4-phenylphenyl)carbazol-9-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole?
1-phenyl-9-[4-phenyl-6-[3-[2-[3-[3-[4-phenyl-6-[1-(4-phenylphenyl)carbazol-9-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole has a molecular weight of 1175.41 g/mol, XLogP of 20.92, 12 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-9-[4-phenyl-6-[3-[2-[3-[3-[4-phenyl-6-[1-(4-phenylphenyl)carbazol-9-yl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole is sourced from PubChem (CID 137397297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).