2-(6H-benzo[c]chromen-1-yl)-4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazine

C40H25N3O2 — CID 169281785

IUPAC2-(6H-benzo[c]chromen-1-yl)-4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazine
SMILESc1ccc(-c2ccc(-c3nc(-c4cccc5c4-c4ccccc4CO5)nc(-c4cccc5c4oc4ccccc45)n3)cc2)cc1
InChIInChI=1S/C40H25N3O2/c1-2-10-25(11-3-1)26-20-22-27(23-21-26)38-41-39(32-16-9-19-35-36(32)29-13-5-4-12-28(29)24-44-35)43-40(42-38)33-17-8-15-31-30-14-6-7-18-34(30)45-37(31)33/h1-23H,24H2
InChIKeyVFBIOLWBMBZYGQ-UHFFFAOYSA-N
MW579.66 g/mol
LogP10.00
Rot. Bonds4

About 2-(6H-benzo[c]chromen-1-yl)-4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazine

2-(6H-benzo[c]chromen-1-yl)-4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazine (PubChem CID 169281785) has the molecular formula C40H25N3O2 and a molecular weight of 579.66 g/mol. Its IUPAC name is 2-(6H-benzo[c]chromen-1-yl)-4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazine.

Molecular Properties

Compound Name2-(6H-benzo[c]chromen-1-yl)-4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazine
PubChem CID169281785
Molecular FormulaC40H25N3O2
Molecular Weight579.66 g/mol
Exact Mass579.19
IUPAC Name2-(6H-benzo[c]chromen-1-yl)-4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazine
SMILESc1ccc(-c2ccc(-c3nc(-c4cccc5c4-c4ccccc4CO5)nc(-c4cccc5c4oc4ccccc45)n3)cc2)cc1
InChIInChI=1S/C40H25N3O2/c1-2-10-25(11-3-1)26-20-22-27(23-21-26)38-41-39(32-16-9-19-35-36(32)29-13-5-4-12-28(29)24-44-35)43-40(42-38)33-17-8-15-31-30-14-6-7-18-34(30)45-37(31)33/h1-23H,24H2
InChIKeyVFBIOLWBMBZYGQ-UHFFFAOYSA-N
XLogP10.00
TPSA61.04 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500579.66
LogP ≤ 510.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-(6H-benzo[c]chromen-1-yl)-4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazine with MolForge

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Related Compounds

2-(3-dibenzofuran-4-ylphenyl)-4-[4-(6,6-dideuteriobenzo[c]chromen-1-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazine
CID 169281810
2-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-4,6-bis(2-phenylphenyl)-1,3,5-triazine
CID 164942421
2-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-4-phenyl-6-(2-phenylphenyl)-1,3,5-triazine
CID 164942555
2-dibenzofuran-4-yl-4-phenyl-6-[3-[4-(4-phenylphenyl)phenyl]phenyl]-1,3,5-triazine
CID 155481524
2-dibenzofuran-4-yl-4-phenyl-6-[4-[4-(4-phenylnaphthalen-1-yl)phenyl]naphthalen-1-yl]-1,3,5-triazine
CID 155481121
2-dibenzofuran-4-yl-4-phenyl-6-[9-(4-phenylphenyl)dibenzofuran-1-yl]-1,3,5-triazine
CID 166741551
2-dibenzofuran-4-yl-4-(5-naphthalen-1-ylnaphthalen-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 168731919
2-dibenzofuran-4-yl-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine
CID 139441684
2-(4-dibenzofuran-4-ylphenyl)-4-(4-phenylphenyl)-6-[4-(3-phenylphenyl)phenyl]-1,3,5-triazine
CID 168850178
2-dibenzofuran-4-yl-4-[4-(6-phenyldibenzofuran-3-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazine
CID 177269991
2-dibenzofuran-4-yl-4-[4-(4-naphthalen-1-ylphenyl)phenyl]-6-(2-phenylphenyl)-1,3,5-triazine
CID 155481357
2-(6-dibenzofuran-4-yldibenzofuran-1-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 166742287

Frequently Asked Questions

What is the IUPAC name of 2-(6H-benzo[c]chromen-1-yl)-4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazine?
The IUPAC name of 2-(6H-benzo[c]chromen-1-yl)-4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazine (CID 169281785) is 2-(6H-benzo[c]chromen-1-yl)-4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazine.
What is the SMILES notation for 2-(6H-benzo[c]chromen-1-yl)-4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazine?
The canonical SMILES for 2-(6H-benzo[c]chromen-1-yl)-4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazine is c1ccc(-c2ccc(-c3nc(-c4cccc5c4-c4ccccc4CO5)nc(-c4cccc5c4oc4ccccc45)n3)cc2)cc1.
What is the InChIKey of 2-(6H-benzo[c]chromen-1-yl)-4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazine?
The InChIKey is VFBIOLWBMBZYGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H25N3O2/c1-2-10-25(11-3-1)26-20-22-27(23-21-26)38-41-39(32-16-9-19-35-36(32)29-13-5-4-12-28(29)24-44-35)43-40(42-38)33-17-8-15-31-30-14-6-7-18-34(30)45-37(31)33/h1-23H,24H2.
What are the key properties of 2-(6H-benzo[c]chromen-1-yl)-4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazine?
2-(6H-benzo[c]chromen-1-yl)-4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazine has a molecular weight of 579.66 g/mol, XLogP of 10.00, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6H-benzo[c]chromen-1-yl)-4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazine is sourced from PubChem (CID 169281785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).