3-carbazol-9-yl-9-(2,6-diphenylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(2-phenyl-6-pyridin-4-ylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)carbazole

C117H75N15 — CID 159118806

About 3-carbazol-9-yl-9-(2,6-diphenylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(2-phenyl-6-pyridin-4-ylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)carbazole

3-carbazol-9-yl-9-(2,6-diphenylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(2-phenyl-6-pyridin-4-ylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)carbazole (PubChem CID 159118806) has the molecular formula C117H75N15 and a molecular weight of 1690.99 g/mol. Its IUPAC name is 3-carbazol-9-yl-9-(2,6-diphenylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(2-phenyl-6-pyridin-4-ylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)carbazole.

Molecular Properties

• Compound Name: 3-carbazol-9-yl-9-(2,6-diphenylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(2-phenyl-6-pyridin-4-ylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)carbazole
• PubChem CID: 159118806
• Molecular Formula: C117H75N15
• Molecular Weight: 1690.99 g/mol
• Exact Mass: 1689.63
• IUPAC Name: 3-carbazol-9-yl-9-(2,6-diphenylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(2-phenyl-6-pyridin-4-ylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)carbazole
• SMILES: c1ccc(-c2cc(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccncc3)cc(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)n2)cc1.c1ccc(-c2nc(-c3ccncc3)nc(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)n2)cc1
• InChI: InChI=1S/C40H26N4.C39H25N5.C38H24N6/c1-3-13-27(14-4-1)34-26-39(42-40(41-34)28-15-5-2-6-16-28)44-37-22-12-9-19-32(37)33-25-29(23-24-38(33)44)43-35-20-10-7-17-30(35)31-18-8-11-21-36(31)43;1-2-10-27(11-3-1)39-41-33(26-20-22-40-23-21-26)25-38(42-39)44-36-17-9-6-14-31(36)32-24-28(18-19-37(32)44)43-34-15-7-4-12-29(34)30-13-5-8-16-35(30)43;1-2-10-25(11-3-1)36-40-37(26-20-22-39-23-21-26)42-38(41-36)44-34-17-9-6-14-30(34)31-24-27(18-19-35(31)44)43-32-15-7-4-12-28(32)29-13-5-8-16-33(29)43/h1-26H;1-25H;1-24H
• InChIKey: KFKQXSFKFQYYSB-UHFFFAOYSA-N
• XLogP: 28.20
• TPSA: 145.59 Ų
• H-Bond Acceptors: 15
• Rotatable Bonds: 12
• Heavy Atoms: 132
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1690.99
LogP ≤ 5	28.20
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	15

Frequently Asked Questions

What is the IUPAC name of 3-carbazol-9-yl-9-(2,6-diphenylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(2-phenyl-6-pyridin-4-ylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)carbazole?

The IUPAC name of 3-carbazol-9-yl-9-(2,6-diphenylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(2-phenyl-6-pyridin-4-ylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)carbazole (CID 159118806) is 3-carbazol-9-yl-9-(2,6-diphenylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(2-phenyl-6-pyridin-4-ylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)carbazole.

What is the SMILES notation for 3-carbazol-9-yl-9-(2,6-diphenylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(2-phenyl-6-pyridin-4-ylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)carbazole?

The canonical SMILES for 3-carbazol-9-yl-9-(2,6-diphenylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(2-phenyl-6-pyridin-4-ylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)carbazole is c1ccc(-c2cc(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccncc3)cc(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)n2)cc1.c1ccc(-c2nc(-c3ccncc3)nc(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)n2)cc1.

What is the InChIKey of 3-carbazol-9-yl-9-(2,6-diphenylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(2-phenyl-6-pyridin-4-ylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)carbazole?

The InChIKey is KFKQXSFKFQYYSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H26N4.C39H25N5.C38H24N6/c1-3-13-27(14-4-1)34-26-39(42-40(41-34)28-15-5-2-6-16-28)44-37-22-12-9-19-32(37)33-25-29(23-24-38(33)44)43-35-20-10-7-17-30(35)31-18-8-11-21-36(31)43;1-2-10-27(11-3-1)39-41-33(26-20-22-40-23-21-26)25-38(42-39)44-36-17-9-6-14-31(36)32-24-28(18-19-37(32)44)43-34-15-7-4-12-29(34)30-13-5-8-16-35(30)43;1-2-10-25(11-3-1)36-40-37(26-20-22-39-23-21-26)42-38(41-36)44-34-17-9-6-14-30(34)31-24-27(18-19-35(31)44)43-32-15-7-4-12-28(32)29-13-5-8-16-33(29)43/h1-26H;1-25H;1-24H.

What are the key properties of 3-carbazol-9-yl-9-(2,6-diphenylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(2-phenyl-6-pyridin-4-ylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)carbazole?

3-carbazol-9-yl-9-(2,6-diphenylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(2-phenyl-6-pyridin-4-ylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)carbazole has a molecular weight of 1690.99 g/mol, XLogP of 28.20, 12 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 3-carbazol-9-yl-9-(2,6-diphenylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(2-phenyl-6-pyridin-4-ylpyrimidin-4-yl)carbazole;3-carbazol-9-yl-9-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)carbazole is sourced from PubChem (CID 159118806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).