2-[4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazol-9-yl]phenyl]-9-phenylcarbazole

C56H36N6 — CID 121306286

IUPAC2-[4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazol-9-yl]phenyl]-9-phenylcarbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccnc(-c4cccc5c4c4ccccc4n5-c4ccc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)cc4)c3)n2)cc1
InChIInChI=1S/C56H36N6/c1-4-15-38(16-5-1)54-58-55(39-17-6-2-7-18-39)60-56(59-54)41-33-34-57-48(35-41)46-23-14-26-51-53(46)47-22-11-13-25-50(47)61(51)43-30-27-37(28-31-43)40-29-32-45-44-21-10-12-24-49(44)62(52(45)36-40)42-19-8-3-9-20-42/h1-36H
InChIKeyMULWQISZFAVAFN-UHFFFAOYSA-N
MW792.95 g/mol
LogP13.80
Rot. Bonds7

About 2-[4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazol-9-yl]phenyl]-9-phenylcarbazole

2-[4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazol-9-yl]phenyl]-9-phenylcarbazole (PubChem CID 121306286) has the molecular formula C56H36N6 and a molecular weight of 792.95 g/mol. Its IUPAC name is 2-[4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazol-9-yl]phenyl]-9-phenylcarbazole.

Molecular Properties

Compound Name2-[4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazol-9-yl]phenyl]-9-phenylcarbazole
PubChem CID121306286
Molecular FormulaC56H36N6
Molecular Weight792.95 g/mol
Exact Mass792.30
IUPAC Name2-[4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazol-9-yl]phenyl]-9-phenylcarbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccnc(-c4cccc5c4c4ccccc4n5-c4ccc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)cc4)c3)n2)cc1
InChIInChI=1S/C56H36N6/c1-4-15-38(16-5-1)54-58-55(39-17-6-2-7-18-39)60-56(59-54)41-33-34-57-48(35-41)46-23-14-26-51-53(46)47-22-11-13-25-50(47)61(51)43-30-27-37(28-31-43)40-29-32-45-44-21-10-12-24-49(44)62(52(45)36-40)42-19-8-3-9-20-42/h1-36H
InChIKeyMULWQISZFAVAFN-UHFFFAOYSA-N
XLogP13.80
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500792.95
LogP ≤ 513.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazol-9-yl]-9-phenylcarbazole
CID 121475615
9-[4-(4-phenylphenyl)phenyl]-4-[4-phenyl-6-[3-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]carbazole
CID 166984413
5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-2,9-diphenylcarbazole;5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,9-diphenylcarbazole
CID 158650135
9-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-(4-phenylphenyl)carbazole
CID 135144167
9-phenyl-4-[4-[4-[4-phenyl-6-(3-pyridin-4-ylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]carbazole
CID 164843456
7-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole
CID 129221779
2-[4-[3-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-9-yl]phenyl]-9-phenylcarbazole;3-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-9-[4-(9-phenylcarbazol-4-yl)phenyl]carbazole
CID 157082857
2-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-2-yl]-9-(4-naphthalen-1-ylphenyl)carbazole
CID 71287119
5-[4-[4-(9-phenylcarbazol-4-yl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]benzo[b]carbazole
CID 146621071
4-(9-phenylcarbazol-4-yl)-9-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 155305706
2-(3-carbazol-9-ylphenyl)-9-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazole
CID 145151686
9-[4-(3-phenylphenyl)phenyl]-2-[4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 155087328

Frequently Asked Questions

What is the IUPAC name of 2-[4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazol-9-yl]phenyl]-9-phenylcarbazole?
The IUPAC name of 2-[4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazol-9-yl]phenyl]-9-phenylcarbazole (CID 121306286) is 2-[4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazol-9-yl]phenyl]-9-phenylcarbazole.
What is the SMILES notation for 2-[4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazol-9-yl]phenyl]-9-phenylcarbazole?
The canonical SMILES for 2-[4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazol-9-yl]phenyl]-9-phenylcarbazole is c1ccc(-c2nc(-c3ccccc3)nc(-c3ccnc(-c4cccc5c4c4ccccc4n5-c4ccc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)cc4)c3)n2)cc1.
What is the InChIKey of 2-[4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazol-9-yl]phenyl]-9-phenylcarbazole?
The InChIKey is MULWQISZFAVAFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H36N6/c1-4-15-38(16-5-1)54-58-55(39-17-6-2-7-18-39)60-56(59-54)41-33-34-57-48(35-41)46-23-14-26-51-53(46)47-22-11-13-25-50(47)61(51)43-30-27-37(28-31-43)40-29-32-45-44-21-10-12-24-49(44)62(52(45)36-40)42-19-8-3-9-20-42/h1-36H.
What are the key properties of 2-[4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazol-9-yl]phenyl]-9-phenylcarbazole?
2-[4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazol-9-yl]phenyl]-9-phenylcarbazole has a molecular weight of 792.95 g/mol, XLogP of 13.80, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-pyridinyl]carbazol-9-yl]phenyl]-9-phenylcarbazole is sourced from PubChem (CID 121306286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).