2-cyano-3-[1-(3-methylbenzyl)-1H-pyrrol-2-yl]-N~1~-[5-(1-pyrrolidinyl)-1,3,4-thiadiazol-2-yl]acrylamide

Chemical Structure Depiction of
2-cyano-3-[1-(3-methylbenzyl)-1H-pyrrol-2-yl]-N~1~-[5-(1-pyrrolidinyl)-1,3,4-thiadiazol-2-yl]acrylamide
Available: 79 mg
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mg
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Compound characteristics

Compound ID: C726-0757
Compound Name: 2-cyano-3-[1-(3-methylbenzyl)-1H-pyrrol-2-yl]-N~1~-[5-(1-pyrrolidinyl)-1,3,4-thiadiazol-2-yl]acrylamide
Molecular Weight: 418.52
Molecular Formula: C22 H22 N6 O S
Smiles: Cc1cccc(Cn2cccc2/C=C(/C#N)C(Nc2nnc(N3CCCC3)s2)=O)c1
Stereo: ACHIRAL
logP: 4.88
logD: 4.85
logSw: -5.63
Hydrogen bond acceptors count: 5
Hydrogen bond donors count: 1
Polar surface area: 131.27
InChI Key: ACKGNSFQXIWNRQ-UHFFFAOYSA-N
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