Home Other Building Blocks 1257426-19-9
1257426-19-9,MFCD28009369
Catalog No.:AA000OIJ

1257426-19-9 | Tba-354

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Purity
Availability
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10mg
≥98%
in stock  
$46.00   $32.00
- +
50mg
≥98%
in stock  
$199.00   $139.00
- +
100mg
≥98%
in stock  
$348.00   $243.00
- +
250mg
≥98%
in stock  
$762.00   $533.00
- +
  • Technical Information
  • Properties
  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA000OIJ
Chemical Name:
Tba-354
CAS Number:
1257426-19-9
Molecular Formula:
C19H15F3N4O5
Molecular Weight:
436.3414
MDL Number:
MFCD28009369
SMILES:
[O-][N+](=O)c1cn2c(n1)OC[C@H](C2)OCc1ccc(nc1)c1ccc(cc1)OC(F)(F)F
Properties
Computed Properties
 
Complexity:
614  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
10  
Rotatable Bond Count:
5  
XLogP3:
3.4  

Literature

Title: Structure-activity relationships for amide-, carbamate-, and urea-linked analogues of the tuberculosis drug (6S)-2-nitro-6-{[4-(trifluoromethoxy)benzyl]oxy}-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazine (PA-824).

Journal: Journal of medicinal chemistry 20120112

Title: Upton AM, et al. In Vitro and In Vivo Activities of the Nitroimidazole TBA-354 against Mycobacterium tuberculosis. Antimicrob Agents Chemother. 2015 Jan;59(1):136-44.

Title: Tasneen R, et al. Contribution of the Nitroimidazoles PA-824 and TBA-354 to the Activity of Novel Regimens in Murine Models of Tuberculosis. Antimicrob Agents Chemother. 2015 Jan;59(1):129-35.

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