ChemicalBook--->CAS DataBase List--->934628-27-0

934628-27-0

934628-27-0 Structure

934628-27-0 Structure
IdentificationBack Directory
[Name]

1-(3-AMINO-2-METHYL-BENZYL)-4-(2-THIOPHEN-2-YL-ETHOXY)-2-PYRIDONE
[CAS]

934628-27-0
[Synonyms]

CG-549
CG0549
CG-0549
CG 0549
CG400549
CG-400549
CG 400549
Nilofabicin
Nilofabicin/CG-400549
Antibiotic,Nilofabicin,inhibit,Inhibitor,Bacterial
1-(3-AMINO-2-METHYL-BENZYL)-4-(2-THIOPHEN-2-YL-ETHOXY)-2-PYRIDONE
1-(3-aMino-2-Methylbenzyl)-4-(2-(thiophen-2-yl)ethoxy)pyridin-2(1H)-one
2(1H)-Pyridinone, 1-[(3-aMino-2-Methylphenyl)Methyl]-4-[2-(2-thienyl)ethoxy]-
[Molecular Formula]

C19H20N2O2S
[MDL Number]

MFCD09991584
[MOL File]

934628-27-0.mol
[Molecular Weight]

340.44
Chemical PropertiesBack Directory
[Boiling point ]

607.1±55.0 °C(Predicted)
[density ]

1.27±0.1 g/cm3(Predicted)
[storage temp. ]

2-8°C(protect from light)
[solubility ]

DMSO : 100 mg/mL (293.74 mM; Need ultrasonic)
[form ]

Solid
[pka]

4.19±0.10(Predicted)
[color ]

White to off-white
[InChI]

1S/C19H20N2O2S/c1-14-15(4-2-6-18(14)20)13-21-9-7-16(12-19(21)22)23-10-8-17-5-3-11-24-17/h2-7,9,11-12H,8,10,13,20H2,1H3
[InChIKey]

YCLREGRRHGLOAK-UHFFFAOYSA-N
[SMILES]

[s]1c(ccc1)CCOC2=CC(=O)N(C=C2)Cc3c(c(ccc3)N)C
Safety DataBack Directory
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

Nilofabicin is an enoyl-(acyl-carrier protein) reductase (FabI) inhibitor. Nilofabicin had an MIC(90) of 0.5 microg/ml for Staphylococcus aureus strains and was more potent than either linezolid or vancomycin[1].
[References]

[1] Jong Hwa Yum,et, al. In Vitro Activities of CG400549, a Novel FabI Inhibitor, against Recently Isolated Clinical Staphylococcal Strains in Korea. Antimicrob Agents Chemother. 2007 Jul; 51(7): 2591–2593.
Spectrum DetailBack Directory
[Spectrum Detail]

1-(3-AMINO-2-METHYL-BENZYL)-4-(2-THIOPHEN-2-YL-ETHOXY)-2-PYRIDONE(934628-27-0)1HNMR
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