14-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-9-phenyl-6-[7-[4-phenyl-6-[4-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene

C96H60N8 — CID 155240870

About 14-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-9-phenyl-6-[7-[4-phenyl-6-[4-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene

14-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-9-phenyl-6-[7-[4-phenyl-6-[4-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene (PubChem CID 155240870) has the molecular formula C96H60N8 and a molecular weight of 1325.59 g/mol. Its IUPAC name is 14-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-9-phenyl-6-[7-[4-phenyl-6-[4-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene.

Molecular Properties

• Compound Name: 14-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-9-phenyl-6-[7-[4-phenyl-6-[4-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
• PubChem CID: 155240870
• Molecular Formula: C96H60N8
• Molecular Weight: 1325.59 g/mol
• Exact Mass: 1324.49
• IUPAC Name: 14-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-9-phenyl-6-[7-[4-phenyl-6-[4-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
• SMILES: c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5c6c7ccc(-c8ccc9ccc(-c%10nc(-c%11ccccc%11)nc(-c%11ccc(-n%12c%13ccccc%13c%13c%14c%15ccccc%15n(-c%15ccccc%15)c%14ccc%13%12)cc%11)n%10)cc9c8)cc7n(-c7ccccc7)c6ccc54)cc3)c2)cc1
• InChI: InChI=1S/C96H60N8/c1-6-22-61(23-7-1)71-58-80(63-24-8-2-9-25-63)97-81(59-71)64-42-47-74(48-43-64)102-84-37-21-18-34-78(84)92-87(102)54-55-88-93(92)79-51-46-68(60-89(79)104(88)73-30-14-5-15-31-73)67-40-38-62-39-41-69(57-70(62)56-67)96-99-94(65-26-10-3-11-27-65)98-95(100-96)66-44-49-75(50-45-66)103-83-36-20-17-33-77(83)91-86(103)53-52-85-90(91)76-32-16-19-35-82(76)101(85)72-28-12-4-13-29-72/h1-60H
• InChIKey: LOWPTKWRDYUGDM-UHFFFAOYSA-N
• XLogP: 24.48
• TPSA: 71.28 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 11
• Heavy Atoms: 104
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1325.59
LogP ≤ 5	24.48
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 14-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-9-phenyl-6-[7-[4-phenyl-6-[4-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene?

The IUPAC name of 14-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-9-phenyl-6-[7-[4-phenyl-6-[4-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene (CID 155240870) is 14-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-9-phenyl-6-[7-[4-phenyl-6-[4-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene.

What is the SMILES notation for 14-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-9-phenyl-6-[7-[4-phenyl-6-[4-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene?

The canonical SMILES for 14-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-9-phenyl-6-[7-[4-phenyl-6-[4-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene is c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5c6c7ccc(-c8ccc9ccc(-c%10nc(-c%11ccccc%11)nc(-c%11ccc(-n%12c%13ccccc%13c%13c%14c%15ccccc%15n(-c%15ccccc%15)c%14ccc%13%12)cc%11)n%10)cc9c8)cc7n(-c7ccccc7)c6ccc54)cc3)c2)cc1.

What is the InChIKey of 14-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-9-phenyl-6-[7-[4-phenyl-6-[4-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene?

The InChIKey is LOWPTKWRDYUGDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C96H60N8/c1-6-22-61(23-7-1)71-58-80(63-24-8-2-9-25-63)97-81(59-71)64-42-47-74(48-43-64)102-84-37-21-18-34-78(84)92-87(102)54-55-88-93(92)79-51-46-68(60-89(79)104(88)73-30-14-5-15-31-73)67-40-38-62-39-41-69(57-70(62)56-67)96-99-94(65-26-10-3-11-27-65)98-95(100-96)66-44-49-75(50-45-66)103-83-36-20-17-33-77(83)91-86(103)53-52-85-90(91)76-32-16-19-35-82(76)101(85)72-28-12-4-13-29-72/h1-60H.

What are the key properties of 14-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-9-phenyl-6-[7-[4-phenyl-6-[4-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene?

14-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-9-phenyl-6-[7-[4-phenyl-6-[4-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene has a molecular weight of 1325.59 g/mol, XLogP of 24.48, 11 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 14-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-9-phenyl-6-[7-[4-phenyl-6-[4-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene is sourced from PubChem (CID 155240870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).