2-{[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]sulfanyl}-N-butylpyridine-3-carboxamide

Chemical Structure Depiction of
2-{[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]sulfanyl}-N-butylpyridine-3-carboxamide
Available: 2 mg
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mg
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Compound characteristics

Compound ID: K781-3264
Compound Name: 2-{[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]sulfanyl}-N-butylpyridine-3-carboxamide
Molecular Weight: 440.33
Molecular Formula: C18 H19 Br F N3 O2 S
Smiles: CCCCNC(c1cccnc1SCC(Nc1ccc(cc1F)[Br])=O)=O
Stereo: ACHIRAL
logP: 3.9577
logD: 3.9501
logSw: -3.8402
Hydrogen bond acceptors count: 6
Hydrogen bond donors count: 2
Polar surface area: 56.124
InChI Key: YRWOWVFPUBZDKO-UHFFFAOYSA-N
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