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

C114H74N8 — CID 158650044

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

12-naphthalen-1-yl-5-[3-[6-phenyl-2-(3-phenylphenyl)pyrimidin-4-yl]phenyl]indolo[3,2-c]carbazole;12-(4-phenylphenyl)-5-[3-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]indolo[3,2-c]carbazole (PubChem CID 158650044) has the molecular formula C114H74N8 and a molecular weight of 1555.90 g/mol. Its IUPAC name is 12-naphthalen-1-yl-5-[3-[6-phenyl-2-(3-phenylphenyl)pyrimidin-4-yl]phenyl]indolo[3,2-c]carbazole;12-(4-phenylphenyl)-5-[3-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]indolo[3,2-c]carbazole.

Molecular Properties

• Compound Name: 12-naphthalen-1-yl-5-[3-[6-phenyl-2-(3-phenylphenyl)pyrimidin-4-yl]phenyl]indolo[3,2-c]carbazole;12-(4-phenylphenyl)-5-[3-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]indolo[3,2-c]carbazole
• PubChem CID: 158650044
• Molecular Formula: C114H74N8
• Molecular Weight: 1555.90 g/mol
• Exact Mass: 1554.60
• IUPAC Name: 12-naphthalen-1-yl-5-[3-[6-phenyl-2-(3-phenylphenyl)pyrimidin-4-yl]phenyl]indolo[3,2-c]carbazole;12-(4-phenylphenyl)-5-[3-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]indolo[3,2-c]carbazole
• SMILES: c1ccc(-c2ccc(-c3cc(-c4ccccc4)nc(-c4cccc(-n5c6ccccc6c6c5ccc5c7ccccc7n(-c7ccc(-c8ccccc8)cc7)c56)c4)n3)cc2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccccc4)cc(-c4cccc(-n5c6ccccc6c6c5ccc5c7ccccc7n(-c7cccc8ccccc78)c56)c4)n3)c2)cc1
• InChI: InChI=1S/C58H38N4.C56H36N4/c1-4-15-39(16-5-1)41-27-29-44(30-28-41)52-38-51(43-19-8-3-9-20-43)59-58(60-52)45-21-14-22-47(37-45)61-54-26-13-11-24-50(54)56-55(61)36-35-49-48-23-10-12-25-53(48)62(57(49)56)46-33-31-42(32-34-46)40-17-6-2-7-18-40;1-3-16-37(17-4-1)40-22-13-24-42(34-40)56-57-48(39-19-5-2-6-20-39)36-49(58-56)41-23-14-25-43(35-41)59-52-30-12-10-28-47(52)54-53(59)33-32-46-45-27-9-11-29-51(45)60(55(46)54)50-31-15-21-38-18-7-8-26-44(38)50/h1-38H;1-36H
• InChIKey: IBKZPEHOIONAAT-UHFFFAOYSA-N
• XLogP: 29.50
• TPSA: 71.28 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 13
• Heavy Atoms: 122
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1555.90
LogP ≤ 5	29.50
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

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

The IUPAC name of 12-naphthalen-1-yl-5-[3-[6-phenyl-2-(3-phenylphenyl)pyrimidin-4-yl]phenyl]indolo[3,2-c]carbazole;12-(4-phenylphenyl)-5-[3-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]indolo[3,2-c]carbazole (CID 158650044) is 12-naphthalen-1-yl-5-[3-[6-phenyl-2-(3-phenylphenyl)pyrimidin-4-yl]phenyl]indolo[3,2-c]carbazole;12-(4-phenylphenyl)-5-[3-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]indolo[3,2-c]carbazole.

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

The canonical SMILES for 12-naphthalen-1-yl-5-[3-[6-phenyl-2-(3-phenylphenyl)pyrimidin-4-yl]phenyl]indolo[3,2-c]carbazole;12-(4-phenylphenyl)-5-[3-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]indolo[3,2-c]carbazole is c1ccc(-c2ccc(-c3cc(-c4ccccc4)nc(-c4cccc(-n5c6ccccc6c6c5ccc5c7ccccc7n(-c7ccc(-c8ccccc8)cc7)c56)c4)n3)cc2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccccc4)cc(-c4cccc(-n5c6ccccc6c6c5ccc5c7ccccc7n(-c7cccc8ccccc78)c56)c4)n3)c2)cc1.

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

The InChIKey is IBKZPEHOIONAAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H38N4.C56H36N4/c1-4-15-39(16-5-1)41-27-29-44(30-28-41)52-38-51(43-19-8-3-9-20-43)59-58(60-52)45-21-14-22-47(37-45)61-54-26-13-11-24-50(54)56-55(61)36-35-49-48-23-10-12-25-53(48)62(57(49)56)46-33-31-42(32-34-46)40-17-6-2-7-18-40;1-3-16-37(17-4-1)40-22-13-24-42(34-40)56-57-48(39-19-5-2-6-20-39)36-49(58-56)41-23-14-25-43(35-41)59-52-30-12-10-28-47(52)54-53(59)33-32-46-45-27-9-11-29-51(45)60(55(46)54)50-31-15-21-38-18-7-8-26-44(38)50/h1-38H;1-36H.

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

12-naphthalen-1-yl-5-[3-[6-phenyl-2-(3-phenylphenyl)pyrimidin-4-yl]phenyl]indolo[3,2-c]carbazole;12-(4-phenylphenyl)-5-[3-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]indolo[3,2-c]carbazole has a molecular weight of 1555.90 g/mol, XLogP of 29.50, 13 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 12-naphthalen-1-yl-5-[3-[6-phenyl-2-(3-phenylphenyl)pyrimidin-4-yl]phenyl]indolo[3,2-c]carbazole;12-(4-phenylphenyl)-5-[3-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]indolo[3,2-c]carbazole is sourced from PubChem (CID 158650044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).