5-(2-{[4-amino-5-(ethoxycarbonyl)pyrimidin-2-yl]sulfanyl}acetamido)-2-chlorobenzoic acid

Chemical Structure Depiction of
5-(2-{[4-amino-5-(ethoxycarbonyl)pyrimidin-2-yl]sulfanyl}acetamido)-2-chlorobenzoic acid
Available: 173 mg
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mg
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Compound characteristics

Compound ID: D133-0057
Compound Name: 5-(2-{[4-amino-5-(ethoxycarbonyl)pyrimidin-2-yl]sulfanyl}acetamido)-2-chlorobenzoic acid
Molecular Weight: 410.83
Molecular Formula: C16 H15 Cl N4 O5 S
Smiles: CCOC(c1cnc(nc1N)SCC(Nc1ccc(c(c1)C(O)=O)[Cl])=O)=O
Stereo: ACHIRAL
logP: 2.6137
logD: -1.1894
logSw: -3.356
Hydrogen bond acceptors count: 11
Hydrogen bond donors count: 4
Polar surface area: 110.79
InChI Key: PEMARKXMPCXFOE-UHFFFAOYSA-N
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