N-benzyl-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Chemical Structure Depiction of
N-benzyl-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
N-benzyl-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Compound characteristics
| Compound ID: | E213-1536 |
| Compound Name: | N-benzyl-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide |
| Molecular Weight: | 297.37 |
| Molecular Formula: | C17 H15 N O2 S |
| Smiles: | C1CSc2c(cccc2C(NCc2ccccc2)=O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.9945 |
| logD: | 2.9945 |
| logSw: | -3.7329 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.82 |
| InChI Key: | NHSLPUJDVUTBJP-UHFFFAOYSA-N |