1-[(2,4-dimethoxyphenyl)methyl]-4-(naphthalene-2-sulfonyl)piperazine--oxalic acid (1/1)
Chemical Structure Depiction of
1-[(2,4-dimethoxyphenyl)methyl]-4-(naphthalene-2-sulfonyl)piperazine--oxalic acid (1/1)
1-[(2,4-dimethoxyphenyl)methyl]-4-(naphthalene-2-sulfonyl)piperazine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 4240-0121 |
| Compound Name: | 1-[(2,4-dimethoxyphenyl)methyl]-4-(naphthalene-2-sulfonyl)piperazine--oxalic acid (1/1) |
| Molecular Weight: | 516.57 |
| Molecular Formula: | C23 H26 N2 O4 S |
| Salt: | HOOCCOOH |
| Smiles: | COc1ccc(CN2CCN(CC2)S(c2ccc3ccccc3c2)(=O)=O)c(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 3.9127 |
| logD: | 3.9087 |
| logSw: | -4.0597 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 50.393 |
| InChI Key: | XYBSWZZBLHOSGW-UHFFFAOYSA-N |