2-[6-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-yl]benzo[g][1,3]benzoxazole

C42H24N4O2 — CID 175633901

IUPAC2-[6-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-yl]benzo[g][1,3]benzoxazole
SMILESc1ccc(-c2nc(-c3cccc4ccccc34)nc(-c3cccc4c3oc3cccc(-c5nc6ccc7ccccc7c6o5)c34)n2)cc1
InChIInChI=1S/C42H24N4O2/c1-2-13-27(14-3-1)39-44-40(30-18-8-15-25-11-4-6-16-28(25)30)46-41(45-39)33-21-9-19-31-36-32(20-10-22-35(36)47-37(31)33)42-43-34-24-23-26-12-5-7-17-29(26)38(34)48-42/h1-24H
InChIKeyYPDWCCKTYHJPMA-UHFFFAOYSA-N
MW616.68 g/mol
LogP10.89
Rot. Bonds4

About 2-[6-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-yl]benzo[g][1,3]benzoxazole

2-[6-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-yl]benzo[g][1,3]benzoxazole (PubChem CID 175633901) has the molecular formula C42H24N4O2 and a molecular weight of 616.68 g/mol. Its IUPAC name is 2-[6-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-yl]benzo[g][1,3]benzoxazole.

Molecular Properties

Compound Name2-[6-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-yl]benzo[g][1,3]benzoxazole
PubChem CID175633901
Molecular FormulaC42H24N4O2
Molecular Weight616.68 g/mol
Exact Mass616.19
IUPAC Name2-[6-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-yl]benzo[g][1,3]benzoxazole
SMILESc1ccc(-c2nc(-c3cccc4ccccc34)nc(-c3cccc4c3oc3cccc(-c5nc6ccc7ccccc7c6o5)c34)n2)cc1
InChIInChI=1S/C42H24N4O2/c1-2-13-27(14-3-1)39-44-40(30-18-8-15-25-11-4-6-16-28(25)30)46-41(45-39)33-21-9-19-31-36-32(20-10-22-35(36)47-37(31)33)42-43-34-24-23-26-12-5-7-17-29(26)38(34)48-42/h1-24H
InChIKeyYPDWCCKTYHJPMA-UHFFFAOYSA-N
XLogP10.89
TPSA77.84 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500616.68
LogP ≤ 510.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-[6-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-yl]benzo[g][1,3]benzoxazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[6-(4-naphthalen-1-ylphenyl)dibenzofuran-1-yl]-4-(5-phenylnaphthalen-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 164808588
2-(6-naphtho[1,2-b][1]benzofuran-7-yldibenzofuran-1-yl)-4,6-diphenyl-1,3,5-triazine
CID 166740940
2-dibenzofuran-4-yl-4-[4-(6-naphthalen-1-yldibenzofuran-1-yl)naphthalen-1-yl]-6-phenyl-1,3,5-triazine
CID 166743398
2-[6-(4-naphthalen-1-ylphenyl)dibenzofuran-1-yl]-4-(7-phenylnaphthalen-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 164808539
2-naphtho[1,2-b][1]benzofuran-7-yl-4,6-bis(4-phenylphenyl)-1,3,5-triazine
CID 155155981
7-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-2-phenyl-[1]benzofuro[2,3-g][1,3]benzoxazole
CID 174288773
8-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-naphthalen-1-ylbenzo[g][1,3]benzoxazole
CID 138633683
5-phenyl-16-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-4,14-dioxa-6-azapentacyclo[11.7.0.02,10.03,7.015,20]icosa-1(13),2(10),3(7),5,8,11,15(20),16,18-nonaene
CID 176647036
2-(5-phenylnaphthalen-1-yl)-4-(4-phenylphenyl)-6-[6-(4-phenylphenyl)dibenzofuran-1-yl]-1,3,5-triazine
CID 164808319
2-[9-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]-1,3-benzoxazole
CID 147547147
2-[6-(4-naphthalen-1-ylphenyl)dibenzofuran-1-yl]-4-(4-phenylphenyl)-6-[4-(3-phenylphenyl)phenyl]-1,3,5-triazine
CID 164808398
2-(7-phenylnaphthalen-1-yl)-4-(4-phenylphenyl)-6-[6-(2-phenylphenyl)dibenzofuran-1-yl]-1,3,5-triazine
CID 164808339

Frequently Asked Questions

What is the IUPAC name of 2-[6-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-yl]benzo[g][1,3]benzoxazole?
The IUPAC name of 2-[6-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-yl]benzo[g][1,3]benzoxazole (CID 175633901) is 2-[6-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-yl]benzo[g][1,3]benzoxazole.
What is the SMILES notation for 2-[6-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-yl]benzo[g][1,3]benzoxazole?
The canonical SMILES for 2-[6-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-yl]benzo[g][1,3]benzoxazole is c1ccc(-c2nc(-c3cccc4ccccc34)nc(-c3cccc4c3oc3cccc(-c5nc6ccc7ccccc7c6o5)c34)n2)cc1.
What is the InChIKey of 2-[6-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-yl]benzo[g][1,3]benzoxazole?
The InChIKey is YPDWCCKTYHJPMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H24N4O2/c1-2-13-27(14-3-1)39-44-40(30-18-8-15-25-11-4-6-16-28(25)30)46-41(45-39)33-21-9-19-31-36-32(20-10-22-35(36)47-37(31)33)42-43-34-24-23-26-12-5-7-17-29(26)38(34)48-42/h1-24H.
What are the key properties of 2-[6-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-yl]benzo[g][1,3]benzoxazole?
2-[6-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-yl]benzo[g][1,3]benzoxazole has a molecular weight of 616.68 g/mol, XLogP of 10.89, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-yl]benzo[g][1,3]benzoxazole is sourced from PubChem (CID 175633901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).