2,6-di-tert-butyl-4-{[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl}phenol--oxalic acid (1/1)
Chemical Structure Depiction of
2,6-di-tert-butyl-4-{[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl}phenol--oxalic acid (1/1)
2,6-di-tert-butyl-4-{[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl}phenol--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 7756-0343 |
| Compound Name: | 2,6-di-tert-butyl-4-{[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl}phenol--oxalic acid (1/1) |
| Molecular Weight: | 498.66 |
| Molecular Formula: | C27 H40 N2 O |
| Salt: | HOOCCOOH |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 6.7082 |
| logD: | 1.8852 |
| logSw: | -5.8359 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 22.4095 |
| InChI Key: | VBMGNBBZBNITHP-UHFFFAOYSA-N |