4-{[2-(2-ethylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]methyl}benzonitrile

Chemical Structure Depiction of
4-{[2-(2-ethylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]methyl}benzonitrile
Available: 94 mg
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mg
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Compound characteristics

Compound ID: K261-1904
Compound Name: 4-{[2-(2-ethylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]methyl}benzonitrile
Molecular Weight: 417.49
Molecular Formula: C23 H19 N3 O3 S
Smiles: CCc1ccccc1N1C(N(Cc2ccc(C#N)cc2)c2ccccc2S1(=O)=O)=O
Stereo: ACHIRAL
logP: 4.6483
logD: 4.6483
logSw: -4.2973
Hydrogen bond acceptors count: 7
Polar surface area: 63.498
InChI Key: ZEHWPKVZEGOTMK-UHFFFAOYSA-N
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