1-(4-bromo-2,6-difluorophenoxy)-3-[4-(3-chlorophenyl)piperazin-1-yl]propan-2-ol--hydrogen chloride (1/2)
Chemical Structure Depiction of
1-(4-bromo-2,6-difluorophenoxy)-3-[4-(3-chlorophenyl)piperazin-1-yl]propan-2-ol--hydrogen chloride (1/2)
1-(4-bromo-2,6-difluorophenoxy)-3-[4-(3-chlorophenyl)piperazin-1-yl]propan-2-ol--hydrogen chloride (1/2)
Compound characteristics
| Compound ID: | 4550-5880 |
| Compound Name: | 1-(4-bromo-2,6-difluorophenoxy)-3-[4-(3-chlorophenyl)piperazin-1-yl]propan-2-ol--hydrogen chloride (1/2) |
| Molecular Weight: | 534.65 |
| Molecular Formula: | C19 H20 Br Cl F2 N2 O2 |
| Salt: | 2HCl |
| Smiles: | C1CN(CCN1CC(COc1c(cc(cc1F)[Br])F)O)c1cccc(c1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7727 |
| logD: | 4.7146 |
| logSw: | -4.6063 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.5232 |
| InChI Key: | HKTSMXZCGDFBOM-INIZCTEOSA-N |