2-naphthalen-1-yl-4-naphthalen-2-yl-6-(5-naphtho[1,2-b][1]benzofuran-5-ylnaphthalen-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(7-naphtho[1,2-b][1]benzofuran-2-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-1-yl-4-(7-naphtho[1,2-b][1]benzothiol-4-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-(3-naphtho[1,2-b][1]benzothiol-3-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazine

C184H110N12O2S2 — CID 163736359

About 2-naphthalen-1-yl-4-naphthalen-2-yl-6-(5-naphtho[1,2-b][1]benzofuran-5-ylnaphthalen-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(7-naphtho[1,2-b][1]benzofuran-2-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-1-yl-4-(7-naphtho[1,2-b][1]benzothiol-4-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-(3-naphtho[1,2-b][1]benzothiol-3-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazine

2-naphthalen-1-yl-4-naphthalen-2-yl-6-(5-naphtho[1,2-b][1]benzofuran-5-ylnaphthalen-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(7-naphtho[1,2-b][1]benzofuran-2-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-1-yl-4-(7-naphtho[1,2-b][1]benzothiol-4-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-(3-naphtho[1,2-b][1]benzothiol-3-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazine (PubChem CID 163736359) has the molecular formula C184H110N12O2S2 and a molecular weight of 2585.12 g/mol. Its IUPAC name is 2-naphthalen-1-yl-4-naphthalen-2-yl-6-(5-naphtho[1,2-b][1]benzofuran-5-ylnaphthalen-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(7-naphtho[1,2-b][1]benzofuran-2-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-1-yl-4-(7-naphtho[1,2-b][1]benzothiol-4-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-(3-naphtho[1,2-b][1]benzothiol-3-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazine.

Molecular Properties

• Compound Name: 2-naphthalen-1-yl-4-naphthalen-2-yl-6-(5-naphtho[1,2-b][1]benzofuran-5-ylnaphthalen-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(7-naphtho[1,2-b][1]benzofuran-2-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-1-yl-4-(7-naphtho[1,2-b][1]benzothiol-4-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-(3-naphtho[1,2-b][1]benzothiol-3-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazine
• PubChem CID: 163736359
• Molecular Formula: C184H110N12O2S2
• Molecular Weight: 2585.12 g/mol
• Exact Mass: 2582.83
• IUPAC Name: 2-naphthalen-1-yl-4-naphthalen-2-yl-6-(5-naphtho[1,2-b][1]benzofuran-5-ylnaphthalen-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(7-naphtho[1,2-b][1]benzofuran-2-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-1-yl-4-(7-naphtho[1,2-b][1]benzothiol-4-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-(3-naphtho[1,2-b][1]benzothiol-3-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazine
• SMILES: c1ccc(-c2nc(-c3ccc4ccc(-c5cccc6c5ccc5c7ccccc7sc65)cc4c3)nc(-c3cccc4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccc4ccccc4c3)nc(-c3cc(-c4ccc5c(ccc6c7ccccc7sc56)c4)cc4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccc4ccccc4c3)nc(-c3ccc4ccc(-c5ccc6ccc7c8ccccc8oc7c6c5)cc4c3)n2)cc1.c1ccc2cc(-c3nc(-c4cccc5ccccc45)nc(-c4cccc5c(-c6cc7c8ccccc8oc7c7ccccc67)cccc45)n3)ccc2c1
• InChI: InChI=1S/C49H29N3O.C45H27N3O.2C45H27N3S/c1-2-14-32-28-33(27-26-30(32)12-1)47-50-48(41-23-9-15-31-13-3-4-16-34(31)41)52-49(51-47)42-24-11-20-35-36(42)21-10-22-37(35)43-29-44-39-18-7-8-25-45(39)53-46(44)40-19-6-5-17-38(40)43;1-2-9-31(10-3-1)43-46-44(35-20-15-28-8-4-5-11-32(28)24-35)48-45(47-43)36-21-16-29-14-18-33(25-37(29)26-36)34-19-17-30-22-23-39-38-12-6-7-13-41(38)49-42(39)40(30)27-34;1-2-11-30(12-3-1)43-46-44(48-45(47-43)40-18-8-13-29-10-4-5-14-34(29)40)32-23-21-28-20-22-31(26-33(28)27-32)35-16-9-17-38-36(35)24-25-39-37-15-6-7-19-41(37)49-42(38)39;1-2-11-29(12-3-1)43-46-44(34-19-18-28-10-4-5-13-30(28)25-34)48-45(47-43)40-27-35(26-32-14-6-7-15-36(32)40)31-20-22-37-33(24-31)21-23-39-38-16-8-9-17-41(38)49-42(37)39/h1-29H;3*1-27H
• InChIKey: LDYFIYYSBAHQIQ-UHFFFAOYSA-N
• XLogP: 49.68
• TPSA: 180.96 Ų
• H-Bond Acceptors: 16
• Rotatable Bonds: 16
• Heavy Atoms: 200
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2585.12
LogP ≤ 5	49.68
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	16

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yl-4-naphthalen-2-yl-6-(5-naphtho[1,2-b][1]benzofuran-5-ylnaphthalen-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(7-naphtho[1,2-b][1]benzofuran-2-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-1-yl-4-(7-naphtho[1,2-b][1]benzothiol-4-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-(3-naphtho[1,2-b][1]benzothiol-3-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazine?

The IUPAC name of 2-naphthalen-1-yl-4-naphthalen-2-yl-6-(5-naphtho[1,2-b][1]benzofuran-5-ylnaphthalen-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(7-naphtho[1,2-b][1]benzofuran-2-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-1-yl-4-(7-naphtho[1,2-b][1]benzothiol-4-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-(3-naphtho[1,2-b][1]benzothiol-3-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazine (CID 163736359) is 2-naphthalen-1-yl-4-naphthalen-2-yl-6-(5-naphtho[1,2-b][1]benzofuran-5-ylnaphthalen-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(7-naphtho[1,2-b][1]benzofuran-2-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-1-yl-4-(7-naphtho[1,2-b][1]benzothiol-4-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-(3-naphtho[1,2-b][1]benzothiol-3-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazine.

What is the SMILES notation for 2-naphthalen-1-yl-4-naphthalen-2-yl-6-(5-naphtho[1,2-b][1]benzofuran-5-ylnaphthalen-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(7-naphtho[1,2-b][1]benzofuran-2-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-1-yl-4-(7-naphtho[1,2-b][1]benzothiol-4-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-(3-naphtho[1,2-b][1]benzothiol-3-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazine?

The canonical SMILES for 2-naphthalen-1-yl-4-naphthalen-2-yl-6-(5-naphtho[1,2-b][1]benzofuran-5-ylnaphthalen-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(7-naphtho[1,2-b][1]benzofuran-2-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-1-yl-4-(7-naphtho[1,2-b][1]benzothiol-4-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-(3-naphtho[1,2-b][1]benzothiol-3-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazine is c1ccc(-c2nc(-c3ccc4ccc(-c5cccc6c5ccc5c7ccccc7sc65)cc4c3)nc(-c3cccc4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccc4ccccc4c3)nc(-c3cc(-c4ccc5c(ccc6c7ccccc7sc56)c4)cc4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccc4ccccc4c3)nc(-c3ccc4ccc(-c5ccc6ccc7c8ccccc8oc7c6c5)cc4c3)n2)cc1.c1ccc2cc(-c3nc(-c4cccc5ccccc45)nc(-c4cccc5c(-c6cc7c8ccccc8oc7c7ccccc67)cccc45)n3)ccc2c1.

What is the InChIKey of 2-naphthalen-1-yl-4-naphthalen-2-yl-6-(5-naphtho[1,2-b][1]benzofuran-5-ylnaphthalen-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(7-naphtho[1,2-b][1]benzofuran-2-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-1-yl-4-(7-naphtho[1,2-b][1]benzothiol-4-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-(3-naphtho[1,2-b][1]benzothiol-3-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazine?

The InChIKey is LDYFIYYSBAHQIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H29N3O.C45H27N3O.2C45H27N3S/c1-2-14-32-28-33(27-26-30(32)12-1)47-50-48(41-23-9-15-31-13-3-4-16-34(31)41)52-49(51-47)42-24-11-20-35-36(42)21-10-22-37(35)43-29-44-39-18-7-8-25-45(39)53-46(44)40-19-6-5-17-38(40)43;1-2-9-31(10-3-1)43-46-44(35-20-15-28-8-4-5-11-32(28)24-35)48-45(47-43)36-21-16-29-14-18-33(25-37(29)26-36)34-19-17-30-22-23-39-38-12-6-7-13-41(38)49-42(39)40(30)27-34;1-2-11-30(12-3-1)43-46-44(48-45(47-43)40-18-8-13-29-10-4-5-14-34(29)40)32-23-21-28-20-22-31(26-33(28)27-32)35-16-9-17-38-36(35)24-25-39-37-15-6-7-19-41(37)49-42(38)39;1-2-11-29(12-3-1)43-46-44(34-19-18-28-10-4-5-13-30(28)25-34)48-45(47-43)40-27-35(26-32-14-6-7-15-36(32)40)31-20-22-37-33(24-31)21-23-39-38-16-8-9-17-41(38)49-42(37)39/h1-29H;3*1-27H.

What are the key properties of 2-naphthalen-1-yl-4-naphthalen-2-yl-6-(5-naphtho[1,2-b][1]benzofuran-5-ylnaphthalen-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(7-naphtho[1,2-b][1]benzofuran-2-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-1-yl-4-(7-naphtho[1,2-b][1]benzothiol-4-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-(3-naphtho[1,2-b][1]benzothiol-3-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazine?

2-naphthalen-1-yl-4-naphthalen-2-yl-6-(5-naphtho[1,2-b][1]benzofuran-5-ylnaphthalen-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(7-naphtho[1,2-b][1]benzofuran-2-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-1-yl-4-(7-naphtho[1,2-b][1]benzothiol-4-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-(3-naphtho[1,2-b][1]benzothiol-3-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazine has a molecular weight of 2585.12 g/mol, XLogP of 49.68, 16 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 2-naphthalen-1-yl-4-naphthalen-2-yl-6-(5-naphtho[1,2-b][1]benzofuran-5-ylnaphthalen-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(7-naphtho[1,2-b][1]benzofuran-2-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-1-yl-4-(7-naphtho[1,2-b][1]benzothiol-4-ylnaphthalen-2-yl)-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-(3-naphtho[1,2-b][1]benzothiol-3-ylnaphthalen-1-yl)-6-phenyl-1,3,5-triazine is sourced from PubChem (CID 163736359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).