1-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-2-(4-methylphenoxy)ethan-1-one--oxalic acid (1/1)
Chemical Structure Depiction of
1-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-2-(4-methylphenoxy)ethan-1-one--oxalic acid (1/1)
1-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-2-(4-methylphenoxy)ethan-1-one--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 4240-0776 |
| Compound Name: | 1-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-2-(4-methylphenoxy)ethan-1-one--oxalic acid (1/1) |
| Molecular Weight: | 482.48 |
| Molecular Formula: | C19 H21 F N2 O4 S |
| Salt: | HOOCCOOH |
| Smiles: | Cc1ccc(cc1)OCC(N1CCN(CC1)S(c1ccc(cc1)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3983 |
| logD: | 2.3983 |
| logSw: | -2.6433 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.377 |
| InChI Key: | SHCLEDPAKRODCL-UHFFFAOYSA-N |