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ChemicalBook--->CAS DataBase List--->957217-65-1

957217-65-1

957217-65-1 Structure

957217-65-1 Structure
IdentificationBack Directory
[Name]

BTZ043 (BTZ038, BTZ044)
[CAS]

957217-65-1
[Synonyms]

BTZ038
BTZ044
BTZ 10526038
BTZ038; BTZ044
BTZ043 (BTZ038, BTZ044)
Benzothiazinone 10526038
2-(3-methyl-1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-8-nitro-6-(trifluoromethyl)-1,3-benzothiazin-4-one
4H-1,3-Benzothiazin-4-one, 2-(2-methyl-1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-8-nitro-6-(trifluoromethyl)-
2-(2-Methyl-1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-8-nitro-6-(trifluoromethyl)-4H-benzo[e][1,3]thiazin-4-one
2-(3-methyl-1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-8-nitro-6-(trifluoromethyl)-1,3-benzothiazin-4-one BTZ043 Racemate
[EINECS(EC#)]

604-604-1
[Molecular Formula]

C17H16F3N3O5S
[MDL Number]

MFCD22420808
[MOL File]

957217-65-1.mol
[Molecular Weight]

431.39
Chemical PropertiesBack Directory
[Boiling point ]

547.6±60.0 °C(Predicted)
[density ]

1.68±0.1 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

insoluble in H2O; ≥10.4 mg/mL in DMSO with gentle warming; ≥3.27 mg/mL in EtOH with gentle warming and ultrasonic
[form ]

solid
[pka]

-0.51±0.20(Predicted)
[color ]

White to light yellow
Spectrum DetailBack Directory
[Spectrum Detail]

BTZ043 (BTZ038, BTZ044)(957217-65-1)1HNMR
Hazard InformationBack Directory
[Biological Activity]

mic: 1 ng/ml (2.3 nm) for m. tuberculosis h37rv and 4 ng/ml (9.2 nm) for mycobacterium smegmatisthe loss of human lives to tuberculosis (tb) continues unabated as a result of poverty, synergy with the hiv/aids pandemic, and the emergence of multidrug- and extensively drug-resistant strains of mycobacterium tuberculosis. btz043 is the most advanced candidate for inclusion in combination therapies for both drug-sensitive and extensively drug-resistant tb.
[in vitro]

btz043 displayed similar activity against all clinical isolates of m. tuberculosis that were tested, including extensively drug-resistant and multidrug-resistant strains, indicating that it targets a previously unknown biological function. btz043 is bactericidal, reducing viability in vitro by more than 1000-fold in under 72 hours, which is comparable to the inh killing effect [1].
[in vivo]

the in vivo efficacy of btz043 was assessed 4 weeks after a low-dose aerosol infection of in the chronic balb/c mice model of tb. four weeks of treatment with btz043 reduced the bacterial load in the lungs and spleens by 1 and 2 logs, respectively, at the concentrations used. additional findings suggest that btz efficacy is time- rather than dose-dependent [1].
[target]

TargetValue
DprE1
[References]

[1] makarov v, manina g, mikusova k, et al. benzothiazinones kill mycobacterium tuberculosis by blocking arabinan synthesis. science. 2009 may 8;324(5928):801-4.
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