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

C90H56N10 — CID 58943291

IUPAC9-[4-carbazol-9-yl-6-[4-[3-[4-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-5-(3,5-diphenylphenyl)phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3cc(-c4ccc(-c5nc(-n6c7ccccc7c7ccccc76)nc(-n6c7ccccc7c7ccccc76)n5)cc4)cc(-c4ccc(-c5nc(-n6c7ccccc7c7ccccc76)nc(-n6c7ccccc7c7ccccc76)n5)cc4)c3)c2)cc1
InChIInChI=1S/C90H56N10/c1-3-23-57(24-4-1)63-51-64(58-25-5-2-6-26-58)54-67(53-63)68-55-65(59-43-47-61(48-44-59)85-91-87(97-77-35-15-7-27-69(77)70-28-8-16-36-78(70)97)95-88(92-85)98-79-37-17-9-29-71(79)72-30-10-18-38-80(72)98)52-66(56-68)60-45-49-62(50-46-60)86-93-89(99-81-39-19-11-31-73(81)74-32-12-20-40-82(74)99)96-90(94-86)100-83-41-21-13-33-75(83)76-34-14-22-42-84(76)100/h1-56H
InChIKeyDWNFCAYLQZKPFH-UHFFFAOYSA-N
MW1277.51 g/mol
LogP22.11
Rot. Bonds11

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

9-[4-carbazol-9-yl-6-[4-[3-[4-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-5-(3,5-diphenylphenyl)phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole (PubChem CID 58943291) has the molecular formula C90H56N10 and a molecular weight of 1277.51 g/mol. Its IUPAC name is 9-[4-carbazol-9-yl-6-[4-[3-[4-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-5-(3,5-diphenylphenyl)phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole.

Molecular Properties

Compound Name9-[4-carbazol-9-yl-6-[4-[3-[4-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-5-(3,5-diphenylphenyl)phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole
PubChem CID58943291
Molecular FormulaC90H56N10
Molecular Weight1277.51 g/mol
Exact Mass1276.47
IUPAC Name9-[4-carbazol-9-yl-6-[4-[3-[4-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-5-(3,5-diphenylphenyl)phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3cc(-c4ccc(-c5nc(-n6c7ccccc7c7ccccc76)nc(-n6c7ccccc7c7ccccc76)n5)cc4)cc(-c4ccc(-c5nc(-n6c7ccccc7c7ccccc76)nc(-n6c7ccccc7c7ccccc76)n5)cc4)c3)c2)cc1
InChIInChI=1S/C90H56N10/c1-3-23-57(24-4-1)63-51-64(58-25-5-2-6-26-58)54-67(53-63)68-55-65(59-43-47-61(48-44-59)85-91-87(97-77-35-15-7-27-69(77)70-28-8-16-36-78(70)97)95-88(92-85)98-79-37-17-9-29-71(79)72-30-10-18-38-80(72)98)52-66(56-68)60-45-49-62(50-46-60)86-93-89(99-81-39-19-11-31-73(81)74-32-12-20-40-82(74)99)96-90(94-86)100-83-41-21-13-33-75(83)76-34-14-22-42-84(76)100/h1-56H
InChIKeyDWNFCAYLQZKPFH-UHFFFAOYSA-N
XLogP22.11
TPSA97.06 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds11
Heavy Atoms100
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001277.51
LogP ≤ 522.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

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

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Frequently Asked Questions

What is the IUPAC name of 9-[4-carbazol-9-yl-6-[4-[3-[4-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-5-(3,5-diphenylphenyl)phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole?
The IUPAC name of 9-[4-carbazol-9-yl-6-[4-[3-[4-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-5-(3,5-diphenylphenyl)phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole (CID 58943291) is 9-[4-carbazol-9-yl-6-[4-[3-[4-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-5-(3,5-diphenylphenyl)phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole.
What is the SMILES notation for 9-[4-carbazol-9-yl-6-[4-[3-[4-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-5-(3,5-diphenylphenyl)phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole?
The canonical SMILES for 9-[4-carbazol-9-yl-6-[4-[3-[4-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-5-(3,5-diphenylphenyl)phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole is c1ccc(-c2cc(-c3ccccc3)cc(-c3cc(-c4ccc(-c5nc(-n6c7ccccc7c7ccccc76)nc(-n6c7ccccc7c7ccccc76)n5)cc4)cc(-c4ccc(-c5nc(-n6c7ccccc7c7ccccc76)nc(-n6c7ccccc7c7ccccc76)n5)cc4)c3)c2)cc1.
What is the InChIKey of 9-[4-carbazol-9-yl-6-[4-[3-[4-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-5-(3,5-diphenylphenyl)phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole?
The InChIKey is DWNFCAYLQZKPFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C90H56N10/c1-3-23-57(24-4-1)63-51-64(58-25-5-2-6-26-58)54-67(53-63)68-55-65(59-43-47-61(48-44-59)85-91-87(97-77-35-15-7-27-69(77)70-28-8-16-36-78(70)97)95-88(92-85)98-79-37-17-9-29-71(79)72-30-10-18-38-80(72)98)52-66(56-68)60-45-49-62(50-46-60)86-93-89(99-81-39-19-11-31-73(81)74-32-12-20-40-82(74)99)96-90(94-86)100-83-41-21-13-33-75(83)76-34-14-22-42-84(76)100/h1-56H.
What are the key properties of 9-[4-carbazol-9-yl-6-[4-[3-[4-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-5-(3,5-diphenylphenyl)phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole?
9-[4-carbazol-9-yl-6-[4-[3-[4-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-5-(3,5-diphenylphenyl)phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole has a molecular weight of 1277.51 g/mol, XLogP of 22.11, 11 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-carbazol-9-yl-6-[4-[3-[4-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-5-(3,5-diphenylphenyl)phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole is sourced from PubChem (CID 58943291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).