TL;DR: RefChem:341024 (CAS 87049-19-2) is a chemical compound with molecular formula C24H44Cl4N4O5 and molecular weight 608.2066 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2,4-bis[2-hydroxy-3-(4-methylpiperazin-1-yl)propoxy]phenyl]ethanone;tetrahydrochloride
Also Known As: Ethanone, 1-(2,4-bis(2-hydroxy-3-(4-methyl-1-piperazinyl)propoxy)phenyl)-, tetrahydrochloride, 2,4-Bis((3-hydroxy-4-methylpiperazinyl)propoxy)acetophenone tetrahydrochloride, 1-(2,4-Bis(2-hydroxy-3-(4-methyl-1-piperazinyl)propoxy)phenyl)ethanone tetrahydrochloride, 1-[2,4-bis[2-hydroxy-3-(4-methylpiperazin-1-yl)propoxy]phenyl]ethanone tetrahydrochloride, 1-{2,4-Bis[2-hydroxy-3-(4-methylpiperazin-1-yl)propoxy]phenyl}ethan-1-one--hydrogen chloride (1/4)
| Molecular Formula | C24H44Cl4N4O5 |
| Molecular Weight | 608.2066 g/mol |
| XLogP | 1.55 |
| Topological Polar Surface Area (TPSA) | 89.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 610.2036 Da |
| Heavy Atoms | 37 |
| Complexity | 581.0 |
| SMILES | CC(=O)C1=C(C=C(C=C1)OCC(CN2CCN(CC2)C)O)OCC(CN3CCN(CC3)C)O.Cl.Cl.Cl.Cl |
| InChIKey | HEQNFQNRFOLLQW-UHFFFAOYSA-N |
The XLogP value of 1.55 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:341024. The TPSA of 89.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:341024. Following Lipinski's Rule of Five, RefChem:341024 has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of RefChem:341024 is 87049-19-2.
The molecular formula of RefChem:341024 is C24H44Cl4N4O5.
The molecular weight of RefChem:341024 is 608.2066 g/mol.
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