ethyl N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,3,3-trifluoro-2-(4-fluorobenzamido)alaninate

Chemical Structure Depiction of
ethyl N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,3,3-trifluoro-2-(4-fluorobenzamido)alaninate
Available: 64 mg
Amount:
mg
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Compound characteristics

Compound ID: 8009-9827
Compound Name: ethyl N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,3,3-trifluoro-2-(4-fluorobenzamido)alaninate
Molecular Weight: 469.46
Molecular Formula: C21 H19 F4 N3 O3 S
Smiles: CCOC(C(C(F)(F)F)(NC(c1ccc(cc1)F)=O)Nc1c(C#N)c2CCCCc2s1)=O
Stereo: RACEMIC MIXTURE
logP: 4.8328
logD: 2.7304
logSw: -4.617
Hydrogen bond acceptors count: 6
Hydrogen bond donors count: 2
Polar surface area: 71.052
InChI Key: QVNDSPOKUQUTCW-HXUWFJFHSA-N
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