5,7-diphenyl-8-phenylmethoxyquinoline

C28H21NO — CID 25164114

IUPAC5,7-diphenyl-8-phenylmethoxyquinoline
SMILESc1ccc(COc2c(-c3ccccc3)cc(-c3ccccc3)c3cccnc23)cc1
InChIInChI=1S/C28H21NO/c1-4-11-21(12-5-1)20-30-28-26(23-15-8-3-9-16-23)19-25(22-13-6-2-7-14-22)24-17-10-18-29-27(24)28/h1-19H,20H2
InChIKeyGBFCRECCLKGFGJ-UHFFFAOYSA-N
MW387.48 g/mol
LogP7.15
Rot. Bonds5

About 5,7-diphenyl-8-phenylmethoxyquinoline

5,7-diphenyl-8-phenylmethoxyquinoline (PubChem CID 25164114) has the molecular formula C28H21NO and a molecular weight of 387.48 g/mol. Its IUPAC name is 5,7-diphenyl-8-phenylmethoxyquinoline.

Molecular Properties

Compound Name5,7-diphenyl-8-phenylmethoxyquinoline
PubChem CID25164114
Molecular FormulaC28H21NO
Molecular Weight387.48 g/mol
Exact Mass387.16
IUPAC Name5,7-diphenyl-8-phenylmethoxyquinoline
SMILESc1ccc(COc2c(-c3ccccc3)cc(-c3ccccc3)c3cccnc23)cc1
InChIInChI=1S/C28H21NO/c1-4-11-21(12-5-1)20-30-28-26(23-15-8-3-9-16-23)19-25(22-13-6-2-7-14-22)24-17-10-18-29-27(24)28/h1-19H,20H2
InChIKeyGBFCRECCLKGFGJ-UHFFFAOYSA-N
XLogP7.15
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.48
LogP ≤ 57.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,7-diphenyl-8-phenylmethoxyquinoline?
The IUPAC name of 5,7-diphenyl-8-phenylmethoxyquinoline (CID 25164114) is 5,7-diphenyl-8-phenylmethoxyquinoline.
What is the SMILES notation for 5,7-diphenyl-8-phenylmethoxyquinoline?
The canonical SMILES for 5,7-diphenyl-8-phenylmethoxyquinoline is c1ccc(COc2c(-c3ccccc3)cc(-c3ccccc3)c3cccnc23)cc1.
What is the InChIKey of 5,7-diphenyl-8-phenylmethoxyquinoline?
The InChIKey is GBFCRECCLKGFGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H21NO/c1-4-11-21(12-5-1)20-30-28-26(23-15-8-3-9-16-23)19-25(22-13-6-2-7-14-22)24-17-10-18-29-27(24)28/h1-19H,20H2.
What are the key properties of 5,7-diphenyl-8-phenylmethoxyquinoline?
5,7-diphenyl-8-phenylmethoxyquinoline has a molecular weight of 387.48 g/mol, XLogP of 7.15, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-diphenyl-8-phenylmethoxyquinoline is sourced from PubChem (CID 25164114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).