30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene

C118H70N10 — CID 158396637

About 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene

30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene (PubChem CID 158396637) has the molecular formula C118H70N10 and a molecular weight of 1627.93 g/mol. Its IUPAC name is 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene.

Molecular Properties

• Compound Name: 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene
• PubChem CID: 158396637
• Molecular Formula: C118H70N10
• Molecular Weight: 1627.93 g/mol
• Exact Mass: 1626.58
• IUPAC Name: 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene
• SMILES: c1ccc(-c2nc(-c3ccc(-n4c5cccc6c5c5c7c(cccc7ccc54)-c4cc5c7ccccc7n(-c7ccccc7)c5cc4-6)cc3)nc(-c3ccc4ccccc4c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5cccc6c5c5c7c(cccc7ccc54)-c4cc5c7ccccc7n(-c7ccccc7)c5cc4-6)c4ccccc34)n2)cc1
• InChI: InChI=1S/2C59H35N5/c1-4-16-37(17-5-1)57-60-58(38-18-6-2-7-19-38)62-59(61-57)45-31-33-50(41-24-11-10-23-40(41)45)64-51-29-15-27-44-47-35-53-48(42-25-12-13-28-49(42)63(53)39-21-8-3-9-22-39)34-46(47)43-26-14-20-36-30-32-52(64)56(54(36)43)55(44)51;1-3-14-38(15-4-1)57-60-58(62-59(61-57)41-26-25-36-13-7-8-16-40(36)33-41)39-27-30-43(31-28-39)64-51-24-12-22-46-48-35-53-49(44-20-9-10-23-50(44)63(53)42-18-5-2-6-19-42)34-47(48)45-21-11-17-37-29-32-52(64)56(54(37)45)55(46)51/h2*1-35H
• InChIKey: GXPUGNAZPSWQCD-UHFFFAOYSA-N
• XLogP: 30.04
• TPSA: 97.06 Ų
• H-Bond Acceptors: 10
• Rotatable Bonds: 10
• Heavy Atoms: 128
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1627.93
LogP ≤ 5	30.04
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	10

Frequently Asked Questions

What is the IUPAC name of 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene?

The IUPAC name of 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene (CID 158396637) is 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene.

What is the SMILES notation for 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene?

The canonical SMILES for 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene is c1ccc(-c2nc(-c3ccc(-n4c5cccc6c5c5c7c(cccc7ccc54)-c4cc5c7ccccc7n(-c7ccccc7)c5cc4-6)cc3)nc(-c3ccc4ccccc4c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5cccc6c5c5c7c(cccc7ccc54)-c4cc5c7ccccc7n(-c7ccccc7)c5cc4-6)c4ccccc34)n2)cc1.

What is the InChIKey of 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene?

The InChIKey is GXPUGNAZPSWQCD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C59H35N5/c1-4-16-37(17-5-1)57-60-58(38-18-6-2-7-19-38)62-59(61-57)45-31-33-50(41-24-11-10-23-40(41)45)64-51-29-15-27-44-47-35-53-48(42-25-12-13-28-49(42)63(53)39-21-8-3-9-22-39)34-46(47)43-26-14-20-36-30-32-52(64)56(54(36)43)55(44)51;1-3-14-38(15-4-1)57-60-58(62-59(61-57)41-26-25-36-13-7-8-16-40(36)33-41)39-27-30-43(31-28-39)64-51-24-12-22-46-48-35-53-49(44-20-9-10-23-50(44)63(53)42-18-5-2-6-19-42)34-47(48)45-21-11-17-37-29-32-52(64)56(54(37)45)55(46)51/h2*1-35H.

What are the key properties of 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene?

30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene has a molecular weight of 1627.93 g/mol, XLogP of 30.04, 10 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-11-phenyl-11,30-diazaoctacyclo[19.7.1.13,28.02,7.08,20.010,18.012,17.025,29]triaconta-1(28),2(7),3,5,8(20),9,12,14,16,18,21,23,25(29),26-tetradecaene is sourced from PubChem (CID 158396637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).