diphenyl-(2-quinolin-2-ylphenyl)methanol

C28H21NO — CID 156790156

IUPACdiphenyl-(2-quinolin-2-ylphenyl)methanol
SMILESOC(c1ccccc1)(c1ccccc1)c1ccccc1-c1ccc2ccccc2n1
InChIInChI=1S/C28H21NO/c30-28(22-12-3-1-4-13-22,23-14-5-2-6-15-23)25-17-9-8-16-24(25)27-20-19-21-11-7-10-18-26(21)29-27/h1-20,30H
InChIKeyPAWJPQDDMGSKRD-UHFFFAOYSA-N
MW387.48 g/mol
LogP6.19
Rot. Bonds4

About diphenyl-(2-quinolin-2-ylphenyl)methanol

diphenyl-(2-quinolin-2-ylphenyl)methanol (PubChem CID 156790156) has the molecular formula C28H21NO and a molecular weight of 387.48 g/mol. Its IUPAC name is diphenyl-(2-quinolin-2-ylphenyl)methanol.

Molecular Properties

Compound Namediphenyl-(2-quinolin-2-ylphenyl)methanol
PubChem CID156790156
Molecular FormulaC28H21NO
Molecular Weight387.48 g/mol
Exact Mass387.16
IUPAC Namediphenyl-(2-quinolin-2-ylphenyl)methanol
SMILESOC(c1ccccc1)(c1ccccc1)c1ccccc1-c1ccc2ccccc2n1
InChIInChI=1S/C28H21NO/c30-28(22-12-3-1-4-13-22,23-14-5-2-6-15-23)25-17-9-8-16-24(25)27-20-19-21-11-7-10-18-26(21)29-27/h1-20,30H
InChIKeyPAWJPQDDMGSKRD-UHFFFAOYSA-N
XLogP6.19
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms30
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.48
LogP ≤ 56.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of diphenyl-(2-quinolin-2-ylphenyl)methanol?
The IUPAC name of diphenyl-(2-quinolin-2-ylphenyl)methanol (CID 156790156) is diphenyl-(2-quinolin-2-ylphenyl)methanol.
What is the SMILES notation for diphenyl-(2-quinolin-2-ylphenyl)methanol?
The canonical SMILES for diphenyl-(2-quinolin-2-ylphenyl)methanol is OC(c1ccccc1)(c1ccccc1)c1ccccc1-c1ccc2ccccc2n1.
What is the InChIKey of diphenyl-(2-quinolin-2-ylphenyl)methanol?
The InChIKey is PAWJPQDDMGSKRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H21NO/c30-28(22-12-3-1-4-13-22,23-14-5-2-6-15-23)25-17-9-8-16-24(25)27-20-19-21-11-7-10-18-26(21)29-27/h1-20,30H.
What are the key properties of diphenyl-(2-quinolin-2-ylphenyl)methanol?
diphenyl-(2-quinolin-2-ylphenyl)methanol has a molecular weight of 387.48 g/mol, XLogP of 6.19, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl-(2-quinolin-2-ylphenyl)methanol is sourced from PubChem (CID 156790156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).