3-(4-hydroxyphenyl)-2-phenylquinazolin-4-one

C20H14N2O2 — CID 708938

IUPAC3-(4-hydroxyphenyl)-2-phenylquinazolin-4-one
SMILESO=c1c2ccccc2nc(-c2ccccc2)n1-c1ccc(O)cc1
InChIInChI=1S/C20H14N2O2/c23-16-12-10-15(11-13-16)22-19(14-6-2-1-3-7-14)21-18-9-5-4-8-17(18)20(22)24/h1-13,23H
InChIKeyAGCPREGHUBUQTJ-UHFFFAOYSA-N
MW314.34 g/mol
LogP3.76
Rot. Bonds2

About 3-(4-hydroxyphenyl)-2-phenylquinazolin-4-one

3-(4-hydroxyphenyl)-2-phenylquinazolin-4-one (PubChem CID 708938) has the molecular formula C20H14N2O2 and a molecular weight of 314.34 g/mol. Its IUPAC name is 3-(4-hydroxyphenyl)-2-phenylquinazolin-4-one.

Molecular Properties

Compound Name3-(4-hydroxyphenyl)-2-phenylquinazolin-4-one
PubChem CID708938
Molecular FormulaC20H14N2O2
Molecular Weight314.34 g/mol
Exact Mass314.11
IUPAC Name3-(4-hydroxyphenyl)-2-phenylquinazolin-4-one
SMILESO=c1c2ccccc2nc(-c2ccccc2)n1-c1ccc(O)cc1
InChIInChI=1S/C20H14N2O2/c23-16-12-10-15(11-13-16)22-19(14-6-2-1-3-7-14)21-18-9-5-4-8-17(18)20(22)24/h1-13,23H
InChIKeyAGCPREGHUBUQTJ-UHFFFAOYSA-N
XLogP3.76
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.34
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(4-hydroxyphenyl)-2-phenylquinazolin-4-one?
The IUPAC name of 3-(4-hydroxyphenyl)-2-phenylquinazolin-4-one (CID 708938) is 3-(4-hydroxyphenyl)-2-phenylquinazolin-4-one.
What is the SMILES notation for 3-(4-hydroxyphenyl)-2-phenylquinazolin-4-one?
The canonical SMILES for 3-(4-hydroxyphenyl)-2-phenylquinazolin-4-one is O=c1c2ccccc2nc(-c2ccccc2)n1-c1ccc(O)cc1.
What is the InChIKey of 3-(4-hydroxyphenyl)-2-phenylquinazolin-4-one?
The InChIKey is AGCPREGHUBUQTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N2O2/c23-16-12-10-15(11-13-16)22-19(14-6-2-1-3-7-14)21-18-9-5-4-8-17(18)20(22)24/h1-13,23H.
What are the key properties of 3-(4-hydroxyphenyl)-2-phenylquinazolin-4-one?
3-(4-hydroxyphenyl)-2-phenylquinazolin-4-one has a molecular weight of 314.34 g/mol, XLogP of 3.76, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-hydroxyphenyl)-2-phenylquinazolin-4-one is sourced from PubChem (CID 708938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).