7-phenyl-5-[7-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-2-yl]indolo[2,3-b]carbazole;7-phenyl-5-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-b]carbazole

C111H71N9 — CID 161361599

About 7-phenyl-5-[7-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-2-yl]indolo[2,3-b]carbazole;7-phenyl-5-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-b]carbazole

7-phenyl-5-[7-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-2-yl]indolo[2,3-b]carbazole;7-phenyl-5-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-b]carbazole (PubChem CID 161361599) has the molecular formula C111H71N9 and a molecular weight of 1530.85 g/mol. Its IUPAC name is 7-phenyl-5-[7-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-2-yl]indolo[2,3-b]carbazole;7-phenyl-5-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-b]carbazole.

Molecular Properties

• Compound Name: 7-phenyl-5-[7-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-2-yl]indolo[2,3-b]carbazole;7-phenyl-5-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-b]carbazole
• PubChem CID: 161361599
• Molecular Formula: C111H71N9
• Molecular Weight: 1530.85 g/mol
• Exact Mass: 1529.58
• IUPAC Name: 7-phenyl-5-[7-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-2-yl]indolo[2,3-b]carbazole;7-phenyl-5-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-b]carbazole
• SMILES: c1ccc(-c2ccc(-c3cc(-c4ccc5ccc(-n6c7ccccc7c7cc8c9ccccc9n(-c9ccccc9)c8cc76)cc5c4)nc(-c4ccccc4)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccc5ccc(-n6c7ccccc7c7cc8c9ccccc9n(-c9ccccc9)c8cc76)cc5c4)n3)cc2)cc1
• InChI: InChI=1S/C56H36N4.C55H35N5/c1-4-14-37(15-5-1)38-24-27-40(28-25-38)50-35-51(58-56(57-50)41-16-6-2-7-17-41)42-29-26-39-30-31-45(33-43(39)32-42)60-53-23-13-11-21-47(53)49-34-48-46-20-10-12-22-52(46)59(54(48)36-55(49)60)44-18-8-3-9-19-44;1-4-14-36(15-5-1)37-24-27-40(28-25-37)54-56-53(39-16-6-2-7-17-39)57-55(58-54)41-29-26-38-30-31-44(33-42(38)32-41)60-50-23-13-11-21-46(50)48-34-47-45-20-10-12-22-49(45)59(51(47)35-52(48)60)43-18-8-3-9-19-43/h1-36H;1-35H
• InChIKey: VPGGJFSREHQGIZ-UHFFFAOYSA-N
• XLogP: 28.38
• TPSA: 84.17 Ų
• H-Bond Acceptors: 9
• Rotatable Bonds: 12
• Heavy Atoms: 120
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1530.85
LogP ≤ 5	28.38
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	9

Frequently Asked Questions

What is the IUPAC name of 7-phenyl-5-[7-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-2-yl]indolo[2,3-b]carbazole;7-phenyl-5-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-b]carbazole?

The IUPAC name of 7-phenyl-5-[7-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-2-yl]indolo[2,3-b]carbazole;7-phenyl-5-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-b]carbazole (CID 161361599) is 7-phenyl-5-[7-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-2-yl]indolo[2,3-b]carbazole;7-phenyl-5-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-b]carbazole.

What is the SMILES notation for 7-phenyl-5-[7-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-2-yl]indolo[2,3-b]carbazole;7-phenyl-5-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-b]carbazole?

The canonical SMILES for 7-phenyl-5-[7-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-2-yl]indolo[2,3-b]carbazole;7-phenyl-5-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-b]carbazole is c1ccc(-c2ccc(-c3cc(-c4ccc5ccc(-n6c7ccccc7c7cc8c9ccccc9n(-c9ccccc9)c8cc76)cc5c4)nc(-c4ccccc4)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccc5ccc(-n6c7ccccc7c7cc8c9ccccc9n(-c9ccccc9)c8cc76)cc5c4)n3)cc2)cc1.

What is the InChIKey of 7-phenyl-5-[7-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-2-yl]indolo[2,3-b]carbazole;7-phenyl-5-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-b]carbazole?

The InChIKey is VPGGJFSREHQGIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H36N4.C55H35N5/c1-4-14-37(15-5-1)38-24-27-40(28-25-38)50-35-51(58-56(57-50)41-16-6-2-7-17-41)42-29-26-39-30-31-45(33-43(39)32-42)60-53-23-13-11-21-47(53)49-34-48-46-20-10-12-22-52(46)59(54(48)36-55(49)60)44-18-8-3-9-19-44;1-4-14-36(15-5-1)37-24-27-40(28-25-37)54-56-53(39-16-6-2-7-17-39)57-55(58-54)41-29-26-38-30-31-44(33-42(38)32-41)60-50-23-13-11-21-46(50)48-34-47-45-20-10-12-22-49(45)59(51(47)35-52(48)60)43-18-8-3-9-19-43/h1-36H;1-35H.

What are the key properties of 7-phenyl-5-[7-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-2-yl]indolo[2,3-b]carbazole;7-phenyl-5-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-b]carbazole?

7-phenyl-5-[7-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-2-yl]indolo[2,3-b]carbazole;7-phenyl-5-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-b]carbazole has a molecular weight of 1530.85 g/mol, XLogP of 28.38, 12 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for 7-phenyl-5-[7-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-2-yl]indolo[2,3-b]carbazole;7-phenyl-5-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]indolo[2,3-b]carbazole is sourced from PubChem (CID 161361599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).