ethyl 3-{[(3-chloro-4-fluorophenyl)carbamothioyl]amino}-4,5,6,7-tetrahydro-1H-[1]benzothieno[2,3-b]pyrrole-2-carboxylate

Chemical Structure Depiction of
ethyl 3-{[(3-chloro-4-fluorophenyl)carbamothioyl]amino}-4,5,6,7-tetrahydro-1H-[1]benzothieno[2,3-b]pyrrole-2-carboxylate
Available: 1000 mg
Amount:
mg
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Compound characteristics

Compound ID: C700-1657
Compound Name: ethyl 3-{[(3-chloro-4-fluorophenyl)carbamothioyl]amino}-4,5,6,7-tetrahydro-1H-[1]benzothieno[2,3-b]pyrrole-2-carboxylate
Molecular Weight: 451.97
Molecular Formula: C20 H19 Cl F N3 O2 S2
Smiles: CCOC(c1c(c2c3CCCCc3sc2[nH]1)NC(Nc1ccc(c(c1)[Cl])F)=S)=O
Stereo: ACHIRAL
logP: 5.5989
logD: 5.5263
logSw: -5.9296
Hydrogen bond acceptors count: 5
Hydrogen bond donors count: 3
Polar surface area: 49.849
InChI Key: XLIQKTDRIDILON-UHFFFAOYSA-N
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