1-methoxy-3-[4-(2-nitrophenyl)piperazin-1-yl]propan-2-ol--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-methoxy-3-[4-(2-nitrophenyl)piperazin-1-yl]propan-2-ol--hydrogen chloride (1/1)
1-methoxy-3-[4-(2-nitrophenyl)piperazin-1-yl]propan-2-ol--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 2023-0164 |
| Compound Name: | 1-methoxy-3-[4-(2-nitrophenyl)piperazin-1-yl]propan-2-ol--hydrogen chloride (1/1) |
| Molecular Weight: | 331.8 |
| Molecular Formula: | C14 H21 N3 O4 |
| Salt: | HCl |
| Smiles: | COCC(CN1CCN(CC1)c1ccccc1[N+]([O-])=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4286 |
| logD: | 1.3761 |
| logSw: | -1.7861 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.326 |
| InChI Key: | TYHGZJMFAMIXCJ-LBPRGKRZSA-N |