6-fluoro-3-[4-(2-phenylethyl)piperazin-1-yl]-4H-1-benzothiopyran-4-one
Chemical Structure Depiction of
6-fluoro-3-[4-(2-phenylethyl)piperazin-1-yl]-4H-1-benzothiopyran-4-one
6-fluoro-3-[4-(2-phenylethyl)piperazin-1-yl]-4H-1-benzothiopyran-4-one
Compound characteristics
| Compound ID: | G617-0245 |
| Compound Name: | 6-fluoro-3-[4-(2-phenylethyl)piperazin-1-yl]-4H-1-benzothiopyran-4-one |
| Molecular Weight: | 368.47 |
| Molecular Formula: | C21 H21 F N2 O S |
| Smiles: | C(CN1CCN(CC1)C1=CSc2ccc(cc2C1=O)F)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2596 |
| logD: | 4.2553 |
| logSw: | -4.2865 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 20.0036 |
| InChI Key: | OJYWAFQLCWITLD-UHFFFAOYSA-N |