12-phenyl-5-[3-[6-phenyl-2-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-1-yl]indolo[3,2-c]carbazole;12-phenyl-5-[6-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]naphthalen-1-yl]indolo[3,2-c]carbazole

C112H72N8 — CID 161348228

About 12-phenyl-5-[3-[6-phenyl-2-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-1-yl]indolo[3,2-c]carbazole;12-phenyl-5-[6-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]naphthalen-1-yl]indolo[3,2-c]carbazole

12-phenyl-5-[3-[6-phenyl-2-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-1-yl]indolo[3,2-c]carbazole;12-phenyl-5-[6-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]naphthalen-1-yl]indolo[3,2-c]carbazole (PubChem CID 161348228) has the molecular formula C112H72N8 and a molecular weight of 1529.86 g/mol. Its IUPAC name is 12-phenyl-5-[3-[6-phenyl-2-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-1-yl]indolo[3,2-c]carbazole;12-phenyl-5-[6-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]naphthalen-1-yl]indolo[3,2-c]carbazole.

Molecular Properties

• Compound Name: 12-phenyl-5-[3-[6-phenyl-2-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-1-yl]indolo[3,2-c]carbazole;12-phenyl-5-[6-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]naphthalen-1-yl]indolo[3,2-c]carbazole
• PubChem CID: 161348228
• Molecular Formula: C112H72N8
• Molecular Weight: 1529.86 g/mol
• Exact Mass: 1528.59
• IUPAC Name: 12-phenyl-5-[3-[6-phenyl-2-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-1-yl]indolo[3,2-c]carbazole;12-phenyl-5-[6-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]naphthalen-1-yl]indolo[3,2-c]carbazole
• SMILES: c1ccc(-c2ccc(-c3cc(-c4ccccc4)nc(-c4ccc5c(-n6c7ccccc7c7c6ccc6c8ccccc8n(-c8ccccc8)c67)cccc5c4)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccccc4)cc(-c4cc(-n5c6ccccc6c6c5ccc5c7ccccc7n(-c7ccccc7)c56)c5ccccc5c4)n3)cc2)cc1
• InChI: InChI=1S/2C56H36N4/c1-4-15-37(16-5-1)38-27-29-40(30-28-38)49-36-48(39-17-6-2-7-18-39)57-56(58-49)42-31-32-44-41(35-42)19-14-26-50(44)60-52-25-13-11-23-47(52)54-53(60)34-33-46-45-22-10-12-24-51(45)59(55(46)54)43-20-8-3-9-21-43;1-4-16-37(17-5-1)38-28-30-40(31-29-38)56-57-48(39-18-6-2-7-19-39)36-49(58-56)42-34-41-20-10-11-23-44(41)53(35-42)60-51-27-15-13-25-47(51)54-52(60)33-32-46-45-24-12-14-26-50(45)59(55(46)54)43-21-8-3-9-22-43/h2*1-36H
• InChIKey: VNOYPMYJNLRBHX-UHFFFAOYSA-N
• XLogP: 28.98
• TPSA: 71.28 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 12
• Heavy Atoms: 120
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1529.86
LogP ≤ 5	28.98
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 12-phenyl-5-[3-[6-phenyl-2-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-1-yl]indolo[3,2-c]carbazole;12-phenyl-5-[6-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]naphthalen-1-yl]indolo[3,2-c]carbazole?

The IUPAC name of 12-phenyl-5-[3-[6-phenyl-2-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-1-yl]indolo[3,2-c]carbazole;12-phenyl-5-[6-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]naphthalen-1-yl]indolo[3,2-c]carbazole (CID 161348228) is 12-phenyl-5-[3-[6-phenyl-2-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-1-yl]indolo[3,2-c]carbazole;12-phenyl-5-[6-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]naphthalen-1-yl]indolo[3,2-c]carbazole.

What is the SMILES notation for 12-phenyl-5-[3-[6-phenyl-2-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-1-yl]indolo[3,2-c]carbazole;12-phenyl-5-[6-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]naphthalen-1-yl]indolo[3,2-c]carbazole?

The canonical SMILES for 12-phenyl-5-[3-[6-phenyl-2-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-1-yl]indolo[3,2-c]carbazole;12-phenyl-5-[6-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]naphthalen-1-yl]indolo[3,2-c]carbazole is c1ccc(-c2ccc(-c3cc(-c4ccccc4)nc(-c4ccc5c(-n6c7ccccc7c7c6ccc6c8ccccc8n(-c8ccccc8)c67)cccc5c4)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccccc4)cc(-c4cc(-n5c6ccccc6c6c5ccc5c7ccccc7n(-c7ccccc7)c56)c5ccccc5c4)n3)cc2)cc1.

What is the InChIKey of 12-phenyl-5-[3-[6-phenyl-2-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-1-yl]indolo[3,2-c]carbazole;12-phenyl-5-[6-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]naphthalen-1-yl]indolo[3,2-c]carbazole?

The InChIKey is VNOYPMYJNLRBHX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C56H36N4/c1-4-15-37(16-5-1)38-27-29-40(30-28-38)49-36-48(39-17-6-2-7-18-39)57-56(58-49)42-31-32-44-41(35-42)19-14-26-50(44)60-52-25-13-11-23-47(52)54-53(60)34-33-46-45-22-10-12-24-51(45)59(55(46)54)43-20-8-3-9-21-43;1-4-16-37(17-5-1)38-28-30-40(31-29-38)56-57-48(39-18-6-2-7-19-39)36-49(58-56)42-34-41-20-10-11-23-44(41)53(35-42)60-51-27-15-13-25-47(51)54-52(60)33-32-46-45-24-12-14-26-50(45)59(55(46)54)43-21-8-3-9-22-43/h2*1-36H.

What are the key properties of 12-phenyl-5-[3-[6-phenyl-2-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-1-yl]indolo[3,2-c]carbazole;12-phenyl-5-[6-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]naphthalen-1-yl]indolo[3,2-c]carbazole?

12-phenyl-5-[3-[6-phenyl-2-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-1-yl]indolo[3,2-c]carbazole;12-phenyl-5-[6-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]naphthalen-1-yl]indolo[3,2-c]carbazole has a molecular weight of 1529.86 g/mol, XLogP of 28.98, 12 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 12-phenyl-5-[3-[6-phenyl-2-(4-phenylphenyl)pyrimidin-4-yl]naphthalen-1-yl]indolo[3,2-c]carbazole;12-phenyl-5-[6-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]naphthalen-1-yl]indolo[3,2-c]carbazole is sourced from PubChem (CID 161348228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).