1-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-3-methoxypropan-2-ol--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-3-methoxypropan-2-ol--hydrogen chloride (1/1)
1-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-3-methoxypropan-2-ol--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 2023-0165 |
| Compound Name: | 1-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-3-methoxypropan-2-ol--hydrogen chloride (1/1) |
| Molecular Weight: | 366.24 |
| Molecular Formula: | C14 H20 Cl N3 O4 |
| Salt: | HCl |
| Smiles: | COCC(CN1CCN(CC1)c1ccc(cc1[Cl])[N+]([O-])=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1272 |
| logD: | 2.1053 |
| logSw: | -2.5771 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.627 |
| InChI Key: | USCJKDUSKMNBTO-LBPRGKRZSA-N |