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 |