7-hydroxy-3-(4-hydroxyphenyl)-5-phenylquinazolin-4-one

C20H14N2O3 — CID 11674336

IUPAC7-hydroxy-3-(4-hydroxyphenyl)-5-phenylquinazolin-4-one
SMILESO=c1c2c(-c3ccccc3)cc(O)cc2ncn1-c1ccc(O)cc1
InChIInChI=1S/C20H14N2O3/c23-15-8-6-14(7-9-15)22-12-21-18-11-16(24)10-17(19(18)20(22)25)13-4-2-1-3-5-13/h1-12,23-24H
InChIKeyQQAAFMHURYSEED-UHFFFAOYSA-N
MW330.34 g/mol
LogP3.46
Rot. Bonds2

About 7-hydroxy-3-(4-hydroxyphenyl)-5-phenylquinazolin-4-one

7-hydroxy-3-(4-hydroxyphenyl)-5-phenylquinazolin-4-one (PubChem CID 11674336) has the molecular formula C20H14N2O3 and a molecular weight of 330.34 g/mol. Its IUPAC name is 7-hydroxy-3-(4-hydroxyphenyl)-5-phenylquinazolin-4-one.

Molecular Properties

Compound Name7-hydroxy-3-(4-hydroxyphenyl)-5-phenylquinazolin-4-one
PubChem CID11674336
Molecular FormulaC20H14N2O3
Molecular Weight330.34 g/mol
Exact Mass330.10
IUPAC Name7-hydroxy-3-(4-hydroxyphenyl)-5-phenylquinazolin-4-one
SMILESO=c1c2c(-c3ccccc3)cc(O)cc2ncn1-c1ccc(O)cc1
InChIInChI=1S/C20H14N2O3/c23-15-8-6-14(7-9-15)22-12-21-18-11-16(24)10-17(19(18)20(22)25)13-4-2-1-3-5-13/h1-12,23-24H
InChIKeyQQAAFMHURYSEED-UHFFFAOYSA-N
XLogP3.46
TPSA75.35 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.34
LogP ≤ 53.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-3-(4-hydroxyphenyl)-5-phenylquinazolin-4-one?
The IUPAC name of 7-hydroxy-3-(4-hydroxyphenyl)-5-phenylquinazolin-4-one (CID 11674336) is 7-hydroxy-3-(4-hydroxyphenyl)-5-phenylquinazolin-4-one.
What is the SMILES notation for 7-hydroxy-3-(4-hydroxyphenyl)-5-phenylquinazolin-4-one?
The canonical SMILES for 7-hydroxy-3-(4-hydroxyphenyl)-5-phenylquinazolin-4-one is O=c1c2c(-c3ccccc3)cc(O)cc2ncn1-c1ccc(O)cc1.
What is the InChIKey of 7-hydroxy-3-(4-hydroxyphenyl)-5-phenylquinazolin-4-one?
The InChIKey is QQAAFMHURYSEED-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N2O3/c23-15-8-6-14(7-9-15)22-12-21-18-11-16(24)10-17(19(18)20(22)25)13-4-2-1-3-5-13/h1-12,23-24H.
What are the key properties of 7-hydroxy-3-(4-hydroxyphenyl)-5-phenylquinazolin-4-one?
7-hydroxy-3-(4-hydroxyphenyl)-5-phenylquinazolin-4-one has a molecular weight of 330.34 g/mol, XLogP of 3.46, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-3-(4-hydroxyphenyl)-5-phenylquinazolin-4-one is sourced from PubChem (CID 11674336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).