(2S)-3-methyl-2-(3-oxo-1,2-benzothiazol-2(3H)-yl)butanoic acid

Chemical Structure Depiction of
(2S)-3-methyl-2-(3-oxo-1,2-benzothiazol-2(3H)-yl)butanoic acid
Available: 39 mg
Amount:
mg
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Compound characteristics

Compound ID: Y041-4794
Compound Name: (2S)-3-methyl-2-(3-oxo-1,2-benzothiazol-2(3H)-yl)butanoic acid
Molecular Weight: 251.3
Molecular Formula: C12 H13 N O3 S
Smiles: CC(C)[C@@H](C(O)=O)N1C(c2ccccc2S1)=O
Stereo: ABSOLUTE
logP: 2.0308
logD: -2.007
logSw: -2.4109
Hydrogen bond acceptors count: 6
Hydrogen bond donors count: 1
Polar surface area: 44.828
InChI Key: WWXBUKVYEVDASM-JTQLQIEISA-N
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