2-acetamido-6-tert-butyl-N-[2-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
2-acetamido-6-tert-butyl-N-[2-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
2-acetamido-6-tert-butyl-N-[2-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
Compound ID: | 4488-2002 |
Compound Name: | 2-acetamido-6-tert-butyl-N-[2-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
Molecular Weight: | 438.51 |
Molecular Formula: | C22 H25 F3 N2 O2 S |
Smiles: | CC(Nc1c(C(Nc2ccccc2C(F)(F)F)=O)c2CCC(Cc2s1)C(C)(C)C)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.6618 |
logD: | 5.5812 |
logSw: | -5.4339 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 45.609 |
InChI Key: | LXISAGGBRNFDBA-CYBMUJFWSA-N |