TL;DR: VU0494511-1 (CAS 1052406-97-9) is a chemical compound with molecular formula C23H33Cl2FN2O3 and molecular weight 474.18524 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2-(2,6-dimethylphenoxy)ethoxy]-3-[4-(4-fluorophenyl)piperazin-1-yl]propan-2-ol;dihydrochloride
Also Known As: VU0494511-1, 1-[2-(2,6-dimethylphenoxy)ethoxy]-3-[4-(4-fluorophenyl)piperazin-1-yl]propan-2-ol Dihydrochloride, F1763-0004, 1-(2-(2,6-dimethylphenoxy)ethoxy)-3-(4-(4-fluorophenyl)piperazin-1-yl)propan-2-ol dihydrochloride, 1-[2-(2,6-dimethylphenoxy)ethoxy]-3-[4-(4-fluorophenyl)piperazin-1-yl]propan-2-ol;dihydrochloride
| Molecular Formula | C23H33Cl2FN2O3 |
| Molecular Weight | 474.18524 g/mol |
| XLogP | 3.86464 |
| Topological Polar Surface Area (TPSA) | 45.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 474.18524 Da |
| Heavy Atoms | 31 |
| Complexity | 443.0 |
| SMILES | CC1=C(C(=CC=C1)C)OCCOCC(CN2CCN(CC2)C3=CC=C(C=C3)F)O.Cl.Cl |
| InChIKey | GLZHKHHMURRJGS-UHFFFAOYSA-N |
The XLogP value of 3.86464 indicates that VU0494511-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.2 Ų, VU0494511-1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, VU0494511-1 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of VU0494511-1 is 1052406-97-9.
The molecular formula of VU0494511-1 is C23H33Cl2FN2O3.
The molecular weight of VU0494511-1 is 474.18524 g/mol.
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