1-(4-chlorobenzene-1-sulfonyl)-4-[(3-ethoxy-4-methoxyphenyl)methyl]piperazine--oxalic acid (1/1)
Chemical Structure Depiction of
1-(4-chlorobenzene-1-sulfonyl)-4-[(3-ethoxy-4-methoxyphenyl)methyl]piperazine--oxalic acid (1/1)
1-(4-chlorobenzene-1-sulfonyl)-4-[(3-ethoxy-4-methoxyphenyl)methyl]piperazine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 4092-0359 |
| Compound Name: | 1-(4-chlorobenzene-1-sulfonyl)-4-[(3-ethoxy-4-methoxyphenyl)methyl]piperazine--oxalic acid (1/1) |
| Molecular Weight: | 514.98 |
| Molecular Formula: | C20 H25 Cl N2 O4 S |
| Salt: | HOOCCOOH |
| Smiles: | CCOc1cc(CN2CCN(CC2)S(c2ccc(cc2)[Cl])(=O)=O)ccc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.003 |
| logD: | 2.9079 |
| logSw: | -3.4 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 50.331 |
| InChI Key: | RCFJLSYRHKUISI-UHFFFAOYSA-N |