1-oxo-N-[3-(trifluoromethyl)phenyl]-1H-2-benzothiopyran-3-carboxamide
Chemical Structure Depiction of
1-oxo-N-[3-(trifluoromethyl)phenyl]-1H-2-benzothiopyran-3-carboxamide
1-oxo-N-[3-(trifluoromethyl)phenyl]-1H-2-benzothiopyran-3-carboxamide
Compound characteristics
Compound ID: | 6451-0736 |
Compound Name: | 1-oxo-N-[3-(trifluoromethyl)phenyl]-1H-2-benzothiopyran-3-carboxamide |
Molecular Weight: | 349.33 |
Molecular Formula: | C17 H10 F3 N O2 S |
Smiles: | C1=C(C(Nc2cccc(c2)C(F)(F)F)=O)SC(c2ccccc12)=O |
Stereo: | ACHIRAL |
logP: | 4.6501 |
logD: | 4.6476 |
logSw: | -4.8114 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 36.323 |
InChI Key: | SJGDJSGBQONOOP-UHFFFAOYSA-N |