2,4-dinaphthalen-1-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine

C137H83N9O3 — CID 165088234

IUPAC2,4-dinaphthalen-1-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine
SMILESc1ccc(-c2cc(-c3nc(-c4ccc5ccccc5c4)nc(-c4cccc5ccccc45)n3)c3c(c2)oc2cc4ccccc4cc23)cc1.c1ccc(-c2cc(-c3nc(-c4cccc5ccccc45)nc(-c4cccc5ccccc45)n3)c3c(c2)oc2cc4ccccc4cc23)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc5ccccc5c4)nc(-c4cc(-c5ccccc5)cc5oc6cc7ccccc7cc6c45)n3)cc2)cc1
InChIInChI=1S/C47H29N3O.2C45H27N3O/c1-3-11-30(12-4-1)33-19-22-34(23-20-33)45-48-46(38-24-21-32-15-7-8-16-35(32)25-38)50-47(49-45)41-27-39(31-13-5-2-6-14-31)29-43-44(41)40-26-36-17-9-10-18-37(36)28-42(40)51-43;1-2-12-28(13-3-1)33-25-39(42-38-24-31-16-4-5-17-32(31)26-40(38)49-41(42)27-33)45-47-43(36-22-10-18-29-14-6-8-20-34(29)36)46-44(48-45)37-23-11-19-30-15-7-9-21-35(30)37;1-2-11-28(12-3-1)35-25-39(42-38-24-32-16-6-7-17-33(32)26-40(38)49-41(42)27-35)45-47-43(34-22-21-29-13-4-5-15-31(29)23-34)46-44(48-45)37-20-10-18-30-14-8-9-19-36(30)37/h1-29H;2*1-27H
InChIKeyWGIOFHFBTRYQOJ-UHFFFAOYSA-N
MW1903.23 g/mol
LogP36.21
Rot. Bonds13

About 2,4-dinaphthalen-1-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine

2,4-dinaphthalen-1-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine (PubChem CID 165088234) has the molecular formula C137H83N9O3 and a molecular weight of 1903.23 g/mol. Its IUPAC name is 2,4-dinaphthalen-1-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine.

Molecular Properties

Compound Name2,4-dinaphthalen-1-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine
PubChem CID165088234
Molecular FormulaC137H83N9O3
Molecular Weight1903.23 g/mol
Exact Mass1901.66
IUPAC Name2,4-dinaphthalen-1-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine
SMILESc1ccc(-c2cc(-c3nc(-c4ccc5ccccc5c4)nc(-c4cccc5ccccc45)n3)c3c(c2)oc2cc4ccccc4cc23)cc1.c1ccc(-c2cc(-c3nc(-c4cccc5ccccc45)nc(-c4cccc5ccccc45)n3)c3c(c2)oc2cc4ccccc4cc23)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc5ccccc5c4)nc(-c4cc(-c5ccccc5)cc5oc6cc7ccccc7cc6c45)n3)cc2)cc1
InChIInChI=1S/C47H29N3O.2C45H27N3O/c1-3-11-30(12-4-1)33-19-22-34(23-20-33)45-48-46(38-24-21-32-15-7-8-16-35(32)25-38)50-47(49-45)41-27-39(31-13-5-2-6-14-31)29-43-44(41)40-26-36-17-9-10-18-37(36)28-42(40)51-43;1-2-12-28(13-3-1)33-25-39(42-38-24-31-16-4-5-17-32(31)26-40(38)49-41(42)27-33)45-47-43(36-22-10-18-29-14-6-8-20-34(29)36)46-44(48-45)37-23-11-19-30-15-7-9-21-35(30)37;1-2-11-28(12-3-1)35-25-39(42-38-24-32-16-6-7-17-33(32)26-40(38)49-41(42)27-35)45-47-43(34-22-21-29-13-4-5-15-31(29)23-34)46-44(48-45)37-20-10-18-30-14-8-9-19-36(30)37/h1-29H;2*1-27H
InChIKeyWGIOFHFBTRYQOJ-UHFFFAOYSA-N
XLogP36.21
TPSA155.43 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds13
Heavy Atoms149
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001903.23
LogP ≤ 536.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 2,4-dinaphthalen-1-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,4-dinaphthalen-1-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine?
The IUPAC name of 2,4-dinaphthalen-1-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine (CID 165088234) is 2,4-dinaphthalen-1-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine.
What is the SMILES notation for 2,4-dinaphthalen-1-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine?
The canonical SMILES for 2,4-dinaphthalen-1-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine is c1ccc(-c2cc(-c3nc(-c4ccc5ccccc5c4)nc(-c4cccc5ccccc45)n3)c3c(c2)oc2cc4ccccc4cc23)cc1.c1ccc(-c2cc(-c3nc(-c4cccc5ccccc45)nc(-c4cccc5ccccc45)n3)c3c(c2)oc2cc4ccccc4cc23)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc5ccccc5c4)nc(-c4cc(-c5ccccc5)cc5oc6cc7ccccc7cc6c45)n3)cc2)cc1.
What is the InChIKey of 2,4-dinaphthalen-1-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine?
The InChIKey is WGIOFHFBTRYQOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C47H29N3O.2C45H27N3O/c1-3-11-30(12-4-1)33-19-22-34(23-20-33)45-48-46(38-24-21-32-15-7-8-16-35(32)25-38)50-47(49-45)41-27-39(31-13-5-2-6-14-31)29-43-44(41)40-26-36-17-9-10-18-37(36)28-42(40)51-43;1-2-12-28(13-3-1)33-25-39(42-38-24-31-16-4-5-17-32(31)26-40(38)49-41(42)27-33)45-47-43(36-22-10-18-29-14-6-8-20-34(29)36)46-44(48-45)37-23-11-19-30-15-7-9-21-35(30)37;1-2-11-28(12-3-1)35-25-39(42-38-24-32-16-6-7-17-33(32)26-40(38)49-41(42)27-35)45-47-43(34-22-21-29-13-4-5-15-31(29)23-34)46-44(48-45)37-20-10-18-30-14-8-9-19-36(30)37/h1-29H;2*1-27H.
What are the key properties of 2,4-dinaphthalen-1-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine?
2,4-dinaphthalen-1-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine has a molecular weight of 1903.23 g/mol, XLogP of 36.21, 13 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dinaphthalen-1-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-1,3,5-triazine;2-naphthalen-2-yl-4-(3-phenylnaphtho[2,3-b][1]benzofuran-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine is sourced from PubChem (CID 165088234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).