1-(benzenesulfonyl)-4-[(3-ethoxy-4-methoxyphenyl)methyl]piperazine--oxalic acid (1/1)
Chemical Structure Depiction of
1-(benzenesulfonyl)-4-[(3-ethoxy-4-methoxyphenyl)methyl]piperazine--oxalic acid (1/1)
1-(benzenesulfonyl)-4-[(3-ethoxy-4-methoxyphenyl)methyl]piperazine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 4092-0457 |
| Compound Name: | 1-(benzenesulfonyl)-4-[(3-ethoxy-4-methoxyphenyl)methyl]piperazine--oxalic acid (1/1) |
| Molecular Weight: | 480.54 |
| Molecular Formula: | C20 H26 N2 O4 S |
| Salt: | HOOCCOOH |
| Smiles: | CCOc1cc(CN2CCN(CC2)S(c2ccccc2)(=O)=O)ccc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.2233 |
| logD: | 2.1281 |
| logSw: | -2.6056 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 50.331 |
| InChI Key: | WAWDEBHVHFVXQH-UHFFFAOYSA-N |