2-(4-Aminophenyl)-4-hydroxyquinazoline; N4'-Me
AlkaPlorer ID: AK009718
Synonym: 2-[4-(Methylamino)phenyl]-4(3H)-quinazolinone
IUPAC Name: 2-[4-(methylamino)phenyl]-3H-quinazolin-4-one
Structure
SMILES: CNC1=CC=C(C2=NC(=O)C3=CC=CC=C3N2)C=C1
InChI: InChI=1S/C15H13N3O/c1-16-11-8-6-10(7-9-11)14-17-13-5-3-2-4-12(13)15(19)18-14/h2-9,16H,1H3,(H,17,18,19)
InChIKey: HPAJBWPBFGTJFP-UHFFFAOYSA-N
Reference
Identification of a Naturally Occurring Quinazolin-4(3<i>H</i>)-one Firefly Luciferase Inhibitor
PubChem CID: 136007811
LOTUS: LTS0033569
NPASS: NPC2823
COCONUT: CNP0218632
{NPAtlas: NPA000233
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces sp. | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 251.28900000000004
TPSA？: 57.78
MolLogP？: 2.6318
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Luciola lateralis | Luciferase | EC50 | 730.0 | nM | 10.1021/np1006179 |
| Luciola lateralis | Luciferase | Inhibition | nan | % | 10.1021/np1006179 |