2-Amino-3H-phenoxazin-3-one; N-Ac 

AlkaPlorer ID: AK013005

Synonym: N-(3-Oxo-3H-phenoxazin-2-yl)acetamide, 2-Acetamido-3H-phenoxazin-3-one, N-Acetylquestiomycin A 

IUPAC Name: N-(3-oxophenoxazin-2-yl)acetamide

Structure

SMILES: CC(O)=NC1=CC2=NC3=CC=CC=C3OC2=CC1=O

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InChI: InChI=1S/C14H10N2O3/c1-8(17)15-10-6-11-14(7-12(10)18)19-13-5-3-2-4-9(13)16-11/h2-7H,1H3,(H,15,17)

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InChIKey: DWOBTNSFRDZSMA-UHFFFAOYSA-N

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Reference

PubChem CID: 193337

CAS: 1916-55-8

SuperNatural Ⅲ: SN0077425

NPASS: NPC297584

COCONUT: CNP0166335

data_source: manually

Properties Information

Molecule Weight: 254.245

TPSA: 75.69

MolLogP: 2.9007000000000014

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Homo sapiens CCRF-CEM IC50 50000.0 nM 10.1021/jm020913z
Homo sapiens CCRF-SB IC50 3600.0 nM 10.1021/jm020913z
Homo sapiens HeLa IC50 8200.0 nM 10.1021/jm020913z
Homo sapiens HEp-2 IC50 1400.0 nM 10.1021/jm020913z
Homo sapiens MT4 IC50 9500.0 nM 10.1021/jm020913z

Metabolism Information