3-anilino-6-nitro-1H-1lambda~6~,2-benzothiazole-1,1-dione

Chemical Structure Depiction of
3-anilino-6-nitro-1H-1lambda~6~,2-benzothiazole-1,1-dione
Available: 1 mg
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mg
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Compound characteristics

Compound ID: 8005-1574
Compound Name: 3-anilino-6-nitro-1H-1lambda~6~,2-benzothiazole-1,1-dione
Molecular Weight: 303.29
Molecular Formula: C13 H9 N3 O4 S
Smiles: c1ccc(cc1)NC1c2ccc(cc2S(N=1)(=O)=O)[N+]([O-])=O
Stereo: ACHIRAL
logP: 2.263
logD: 2.2564
logSw: -3.1588
Hydrogen bond acceptors count: 9
Hydrogen bond donors count: 1
Polar surface area: 84.226
InChI Key: XTIQMHFSRMXIJU-UHFFFAOYSA-N
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