ethyl 2-{[5-chloro-2-(methanesulfonyl)pyrimidine-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Chemical Structure Depiction of
ethyl 2-{[5-chloro-2-(methanesulfonyl)pyrimidine-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Available: 74 mg
Amount:
mg
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Compound characteristics

Compound ID: D053-0232
Compound Name: ethyl 2-{[5-chloro-2-(methanesulfonyl)pyrimidine-4-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Molecular Weight: 443.93
Molecular Formula: C17 H18 Cl N3 O5 S2
Smiles: [H]N(C(c1c(cnc(n1)S(C)(=O)=O)[Cl])=O)c1c(C(=O)OCC)c2CCCCc2s1
Stereo: ACHIRAL
logP: 2.7886
logD: -3.1646
logSw: -3.7493
Hydrogen bond acceptors count: 11
Hydrogen bond donors count: 1
Polar surface area: 92.96
InChI Key: ZSWSTWFQKGXRGH-UHFFFAOYSA-N
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