2,6-dimethoxy-4-{[4-(propane-1-sulfonyl)piperazin-1-yl]methyl}phenol--oxalic acid (1/1)
Chemical Structure Depiction of
2,6-dimethoxy-4-{[4-(propane-1-sulfonyl)piperazin-1-yl]methyl}phenol--oxalic acid (1/1)
2,6-dimethoxy-4-{[4-(propane-1-sulfonyl)piperazin-1-yl]methyl}phenol--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 4240-0415 |
| Compound Name: | 2,6-dimethoxy-4-{[4-(propane-1-sulfonyl)piperazin-1-yl]methyl}phenol--oxalic acid (1/1) |
| Molecular Weight: | 448.49 |
| Molecular Formula: | C16 H26 N2 O5 S |
| Salt: | HOOCCOOH |
| Smiles: | CCCS(N1CCN(CC1)Cc1cc(c(c(c1)OC)O)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6358 |
| logD: | -0.2756 |
| logSw: | -1.6846 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.396 |
| InChI Key: | MTUKYPIKOGCPME-UHFFFAOYSA-N |