methyl N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,3,3-trifluoro-2-[(furan-2-carbonyl)amino]alaninate

Chemical Structure Depiction of
methyl N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,3,3-trifluoro-2-[(furan-2-carbonyl)amino]alaninate
Available: 34 mg
Amount:
mg
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Compound characteristics

Compound ID: 8012-1249
Compound Name: methyl N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,3,3-trifluoro-2-[(furan-2-carbonyl)amino]alaninate
Molecular Weight: 483.51
Molecular Formula: C22 H24 F3 N3 O4 S
Smiles: CC(C)(C)C1CCc2c(C#N)c(NC(C(=O)OC)(C(F)(F)F)NC(c3ccco3)=O)sc2C1
Stereo: MIXTURE OF STEREOISOMERS
logP: 5.2114
logD: 4.4238
logSw: -5.1711
Hydrogen bond acceptors count: 7
Hydrogen bond donors count: 2
Polar surface area: 80.05
InChI Key: DQJLUSKHHOWHMY-UHFFFAOYSA-N
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