methyl 4-{2-[(3-methyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetamido}benzoate

Chemical Structure Depiction of
methyl 4-{2-[(3-methyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetamido}benzoate
Available: 163 mg
Amount:
mg
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Compound characteristics

Compound ID: G856-3779
Compound Name: methyl 4-{2-[(3-methyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-7-yl)sulfanyl]acetamido}benzoate
Molecular Weight: 391.42
Molecular Formula: C15 H13 N5 O4 S2
Smiles: CC1C(N2C(=NN=1)SC(=N2)SCC(Nc1ccc(cc1)C(=O)OC)=O)=O
Stereo: ACHIRAL
logP: 2.6611
logD: 2.6572
logSw: -3.0197
Hydrogen bond acceptors count: 12
Hydrogen bond donors count: 1
Polar surface area: 92.012
InChI Key: MEPAAWQSYJNZRJ-UHFFFAOYSA-N
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