2-(5-acetamido-3-acetyl-2,3-dihydro-1,3,4-thiadiazol-2-yl)-4-methylphenyl 4-methylbenzene-1-sulfonate

Chemical Structure Depiction of
2-(5-acetamido-3-acetyl-2,3-dihydro-1,3,4-thiadiazol-2-yl)-4-methylphenyl 4-methylbenzene-1-sulfonate
Available: 140 mg
Amount:
mg
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Compound characteristics

Compound ID: D336-7529
Compound Name: 2-(5-acetamido-3-acetyl-2,3-dihydro-1,3,4-thiadiazol-2-yl)-4-methylphenyl 4-methylbenzene-1-sulfonate
Molecular Weight: 447.53
Molecular Formula: C20 H21 N3 O5 S2
Smiles: CC(NC1=NN(C(c2cc(C)ccc2OS(c2ccc(C)cc2)(=O)=O)S1)C(C)=O)=O
Stereo: RACEMIC MIXTURE
logP: 3.4281
logD: 3.3817
logSw: -3.7026
Hydrogen bond acceptors count: 11
Hydrogen bond donors count: 1
Polar surface area: 86.991
InChI Key: PDOQGRYBDJBGRM-IBGZPJMESA-N
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