prop-2-en-1-yl 4-methyl-2-{2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamido}-1,3-thiazole-5-carboxylate

Chemical Structure Depiction of
prop-2-en-1-yl 4-methyl-2-{2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamido}-1,3-thiazole-5-carboxylate
Available: 311 mg
Amount:
mg
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Compound characteristics

Compound ID: D278-0695
Compound Name: prop-2-en-1-yl 4-methyl-2-{2-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamido}-1,3-thiazole-5-carboxylate
Molecular Weight: 453.54
Molecular Formula: C21 H19 N5 O3 S2
Smiles: Cc1cc2nnc(n2c2ccccc12)SCC(Nc1nc(C)c(C(=O)OCC=C)s1)=O
Stereo: ACHIRAL
logP: 4.0881
logD: 4.0482
logSw: -4.1876
Hydrogen bond acceptors count: 9
Hydrogen bond donors count: 1
Polar surface area: 75.902
InChI Key: RMHZZGXXTQDLFY-UHFFFAOYSA-N
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