3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-6-fluoro-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-6-fluoro-2H-1-benzopyran-2-one
3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-6-fluoro-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | F312-0081 |
| Compound Name: | 3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-6-fluoro-2H-1-benzopyran-2-one |
| Molecular Weight: | 359.37 |
| Molecular Formula: | C18 H14 F N O4 S |
| Smiles: | C1CN(Cc2ccccc12)S(C1=Cc2cc(ccc2OC1=O)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1173 |
| logD: | 3.1173 |
| logSw: | -3.4915 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.533 |
| InChI Key: | MMYZVKJRDAOTCD-UHFFFAOYSA-N |