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2-(4-hydroxybenzyl)quinazolin-4(3H)-one

AlkaPlorer ID: AK051426

Synonym: '2-(4-hydroxybenzyl)quinazolin-4(3H)-one'

IUPAC Name: 2-[(4-hydroxyphenyl)methyl]-3H-quinazolin-4-one

Structure

SMILES: OC1=CC=C(CC2=NC(O)=C3C=CC=CC3=N2)C=C1

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InChI: InChI=1S/C15H12N2O2/c18-11-7-5-10(6-8-11)9-14-16-13-4-2-1-3-12(13)15(19)17-14/h1-8,18H,9H2,(H,16,17,19)

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InChIKey: MVWHKEGFSBSUSY-UHFFFAOYSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain

Properties Information

Molecule Weight: 252.27300000000005

TPSA？: 66.24000000000001

MolLogP？: 2.6318

Number of H-Donors: 2

Number of H-Acceptors: 4

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Alternaria brassicae Alternaria brassicae Activity nan None 10.1021/np200037z
Aspergillus niger Aspergillus niger Activity nan None 10.1021/np200037z
Botryosphaeria berengeriana Botryosphaeria berengeriana Activity nan None 10.1021/np200037z
Escherichia coli Escherichia coli Activity nan None 10.1021/np200037z
Fusarium oxysporum f. sp. vasinfectum Fusarium oxysporum f. sp. vasinfectum Activity nan None 10.1021/np200037z
Homo sapiens A549 IC50 17500.0 nM 10.1021/np200037z
Homo sapiens A549 IC50 120000.0 nM 10.1021/np100568w
Homo sapiens A549 IC50 150000.0 nM 10.1021/np100568w
Homo sapiens Bel-7402 IC50 19800.0 nM 10.1021/np200037z
Staphylococcus aureus Staphylococcus aureus Activity nan None 10.1021/np200037z
Staphylococcus aureus Staphylococcus aureus IC50 150000.0 nM 10.1021/np100568w
Streptococcus pneumoniae Streptococcus pneumoniae IC50 150000.0 nM 10.1021/np100568w
None Molecular identity unknown Activity nan None 10.1021/np200037z

Metabolism Information