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

C108H70N10 — CID 158449783

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

3-phenyl-9-[4-[3-(9-phenylcarbazol-2-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;3-phenyl-9-[4-(9-phenylcarbazol-3-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole (PubChem CID 158449783) has the molecular formula C108H70N10 and a molecular weight of 1507.82 g/mol. Its IUPAC name is 3-phenyl-9-[4-[3-(9-phenylcarbazol-2-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;3-phenyl-9-[4-(9-phenylcarbazol-3-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole.

Molecular Properties

• Compound Name: 3-phenyl-9-[4-[3-(9-phenylcarbazol-2-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;3-phenyl-9-[4-(9-phenylcarbazol-3-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole
• PubChem CID: 158449783
• Molecular Formula: C108H70N10
• Molecular Weight: 1507.82 g/mol
• Exact Mass: 1506.58
• IUPAC Name: 3-phenyl-9-[4-[3-(9-phenylcarbazol-2-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;3-phenyl-9-[4-(9-phenylcarbazol-3-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole
• SMILES: c1ccc(-c2ccc(-c3nc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)nc(-n4c5ccccc5c5cc(-c6ccccc6)ccc54)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4cccc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)c4)nc(-n4c5ccccc5c5cc(-c6ccccc6)ccc54)n3)cc2)cc1
• InChI: InChI=1S/C57H37N5.C51H33N5/c1-4-15-38(16-5-1)40-27-29-41(30-28-40)55-58-56(60-57(59-55)62-52-26-13-11-24-48(52)50-36-43(32-34-53(50)62)39-17-6-2-7-18-39)45-20-14-19-42(35-45)44-31-33-49-47-23-10-12-25-51(47)61(54(49)37-44)46-21-8-3-9-22-46;1-4-14-34(15-5-1)36-24-26-37(27-25-36)49-52-50(39-29-31-47-44(33-39)41-20-10-12-22-45(41)55(47)40-18-8-3-9-19-40)54-51(53-49)56-46-23-13-11-21-42(46)43-32-38(28-30-48(43)56)35-16-6-2-7-17-35/h1-37H;1-33H
• InChIKey: HDVKQKOVEKOPNT-UHFFFAOYSA-N
• XLogP: 27.13
• TPSA: 97.06 Ų
• H-Bond Acceptors: 10
• Rotatable Bonds: 13
• Heavy Atoms: 118
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1507.82
LogP ≤ 5	27.13
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	10

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-9-[4-[3-(9-phenylcarbazol-2-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;3-phenyl-9-[4-(9-phenylcarbazol-3-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole?

The IUPAC name of 3-phenyl-9-[4-[3-(9-phenylcarbazol-2-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;3-phenyl-9-[4-(9-phenylcarbazol-3-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole (CID 158449783) is 3-phenyl-9-[4-[3-(9-phenylcarbazol-2-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;3-phenyl-9-[4-(9-phenylcarbazol-3-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole.

What is the SMILES notation for 3-phenyl-9-[4-[3-(9-phenylcarbazol-2-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;3-phenyl-9-[4-(9-phenylcarbazol-3-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole?

The canonical SMILES for 3-phenyl-9-[4-[3-(9-phenylcarbazol-2-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;3-phenyl-9-[4-(9-phenylcarbazol-3-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole is c1ccc(-c2ccc(-c3nc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)nc(-n4c5ccccc5c5cc(-c6ccccc6)ccc54)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4cccc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)c4)nc(-n4c5ccccc5c5cc(-c6ccccc6)ccc54)n3)cc2)cc1.

What is the InChIKey of 3-phenyl-9-[4-[3-(9-phenylcarbazol-2-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;3-phenyl-9-[4-(9-phenylcarbazol-3-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole?

The InChIKey is HDVKQKOVEKOPNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H37N5.C51H33N5/c1-4-15-38(16-5-1)40-27-29-41(30-28-40)55-58-56(60-57(59-55)62-52-26-13-11-24-48(52)50-36-43(32-34-53(50)62)39-17-6-2-7-18-39)45-20-14-19-42(35-45)44-31-33-49-47-23-10-12-25-51(47)61(54(49)37-44)46-21-8-3-9-22-46;1-4-14-34(15-5-1)36-24-26-37(27-25-36)49-52-50(39-29-31-47-44(33-39)41-20-10-12-22-45(41)55(47)40-18-8-3-9-19-40)54-51(53-49)56-46-23-13-11-21-42(46)43-32-38(28-30-48(43)56)35-16-6-2-7-17-35/h1-37H;1-33H.

What are the key properties of 3-phenyl-9-[4-[3-(9-phenylcarbazol-2-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;3-phenyl-9-[4-(9-phenylcarbazol-3-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole?

3-phenyl-9-[4-[3-(9-phenylcarbazol-2-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;3-phenyl-9-[4-(9-phenylcarbazol-3-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole has a molecular weight of 1507.82 g/mol, XLogP of 27.13, 13 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 3-phenyl-9-[4-[3-(9-phenylcarbazol-2-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;3-phenyl-9-[4-(9-phenylcarbazol-3-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole is sourced from PubChem (CID 158449783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).