N~1~-(5-benzyl-1,3,4-thiadiazol-2-yl)-3-[3-chloro-5-methoxy-4-(2-phenoxyethoxy)phenyl]-2-cyanoacrylamide

Chemical Structure Depiction of
N~1~-(5-benzyl-1,3,4-thiadiazol-2-yl)-3-[3-chloro-5-methoxy-4-(2-phenoxyethoxy)phenyl]-2-cyanoacrylamide
Available: 128 mg
Amount:
mg
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Compound characteristics

Compound ID: 4272-0563
Compound Name: N~1~-(5-benzyl-1,3,4-thiadiazol-2-yl)-3-[3-chloro-5-methoxy-4-(2-phenoxyethoxy)phenyl]-2-cyanoacrylamide
Molecular Weight: 547.03
Molecular Formula: C28 H23 Cl N4 O4 S
Smiles: COc1cc(/C=C(/C#N)C(Nc2nnc(Cc3ccccc3)s2)=O)cc(c1OCCOc1ccccc1)[Cl]
Stereo: ACHIRAL
logP: 6.26
logD: 4.96
logSw: -7.47
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 1
Polar surface area: 161.24
InChI Key: DHCDYHYMMJBAKU-UHFFFAOYSA-N
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