12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-12,15-diazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,7,12,15-tetrazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-4,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene

C168H104N24 — CID 158023754

About 12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-12,15-diazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,7,12,15-tetrazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-4,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene

12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-12,15-diazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,7,12,15-tetrazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-4,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene (PubChem CID 158023754) has the molecular formula C168H104N24 and a molecular weight of 2458.85 g/mol. Its IUPAC name is 12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-12,15-diazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,7,12,15-tetrazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-4,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene.

Molecular Properties

• Compound Name: 12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-12,15-diazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,7,12,15-tetrazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-4,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene
• PubChem CID: 158023754
• Molecular Formula: C168H104N24
• Molecular Weight: 2458.85 g/mol
• Exact Mass: 2456.89
• IUPAC Name: 12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-12,15-diazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,7,12,15-tetrazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-4,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene
• SMILES: c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccc5ccccc5c4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccc5cccnc5c4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccc5ccncc5c4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccc5ncncc5c4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)n2)cc1
• InChI: InChI=1S/C43H27N5.2C42H26N6.C41H25N7/c1-4-15-29(16-5-1)41-44-42(30-17-6-2-7-18-30)46-43(45-41)48-37-27-24-28-14-10-11-21-32(28)38(37)35-26-25-34-33-22-12-13-23-36(33)47(39(34)40(35)48)31-19-8-3-9-20-31;1-4-13-28(14-5-1)40-44-41(29-15-6-2-7-16-29)46-42(45-40)48-35-25-22-27-17-12-26-43-37(27)36(35)33-24-23-32-31-20-10-11-21-34(31)47(38(32)39(33)48)30-18-8-3-9-19-30;1-4-12-28(13-5-1)40-44-41(29-14-6-2-7-15-29)46-42(45-40)48-36-23-20-27-24-25-43-26-34(27)37(36)33-22-21-32-31-18-10-11-19-35(31)47(38(32)39(33)48)30-16-8-3-9-17-30;1-4-12-26(13-5-1)39-44-40(27-14-6-2-7-15-27)46-41(45-39)48-35-23-22-33-32(24-42-25-43-33)36(35)31-21-20-30-29-18-10-11-19-34(29)47(37(30)38(31)48)28-16-8-3-9-17-28/h1-27H;2*1-26H;1-25H
• InChIKey: FGJCSUZBSKRDES-UHFFFAOYSA-N
• XLogP: 39.79
• TPSA: 245.68 Ų
• H-Bond Acceptors: 24
• Rotatable Bonds: 16
• Heavy Atoms: 192
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2458.85
LogP ≤ 5	39.79
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	24

Frequently Asked Questions

What is the IUPAC name of 12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-12,15-diazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,7,12,15-tetrazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-4,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene?

The IUPAC name of 12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-12,15-diazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,7,12,15-tetrazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-4,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene (CID 158023754) is 12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-12,15-diazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,7,12,15-tetrazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-4,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene.

What is the SMILES notation for 12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-12,15-diazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,7,12,15-tetrazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-4,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene?

The canonical SMILES for 12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-12,15-diazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,7,12,15-tetrazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-4,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene is c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccc5ccccc5c4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccc5cccnc5c4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccc5ccncc5c4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccc5ncncc5c4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)n2)cc1.

What is the InChIKey of 12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-12,15-diazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,7,12,15-tetrazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-4,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene?

The InChIKey is FGJCSUZBSKRDES-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H27N5.2C42H26N6.C41H25N7/c1-4-15-29(16-5-1)41-44-42(30-17-6-2-7-18-30)46-43(45-41)48-37-27-24-28-14-10-11-21-32(28)38(37)35-26-25-34-33-22-12-13-23-36(33)47(39(34)40(35)48)31-19-8-3-9-20-31;1-4-13-28(14-5-1)40-44-41(29-15-6-2-7-16-29)46-42(45-40)48-35-25-22-27-17-12-26-43-37(27)36(35)33-24-23-32-31-20-10-11-21-34(31)47(38(32)39(33)48)30-18-8-3-9-19-30;1-4-12-28(13-5-1)40-44-41(29-14-6-2-7-15-29)46-42(45-40)48-36-23-20-27-24-25-43-26-34(27)37(36)33-22-21-32-31-18-10-11-19-35(31)47(38(32)39(33)48)30-16-8-3-9-17-30;1-4-12-26(13-5-1)39-44-40(27-14-6-2-7-15-27)46-41(45-39)48-35-23-22-33-32(24-42-25-43-33)36(35)31-21-20-30-29-18-10-11-19-34(29)47(37(30)38(31)48)28-16-8-3-9-17-28/h1-27H;2*1-26H;1-25H.

What are the key properties of 12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-12,15-diazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,7,12,15-tetrazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-4,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene?

12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-12,15-diazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,7,12,15-tetrazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-4,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene has a molecular weight of 2458.85 g/mol, XLogP of 39.79, 16 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-12,15-diazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,7,12,15-tetrazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-4,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-5,12,15-triazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3(8),4,6,9,14(22),16,18,20,23-undecaene is sourced from PubChem (CID 158023754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).