TL;DR: RefChem:341025 (CAS 87049-18-1) is a chemical compound with molecular formula C22H36Cl2N2O7 and molecular weight 510.18997 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2,4-bis(2-hydroxy-3-morpholin-4-ium-4-ylpropoxy)phenyl]ethanone dichloride
Also Known As: 2,4-Bis((2-hydroxy-3-morpholino)propoxy)acetophenone dihydrochloride, Ethanone, 1-(2,4-bis(2-hydroxy-3-(4-morpholinyl)propoxy)phenyl)-, dihydrochloride, 1-(2,4-Bis(2-hydroxy-3-(4-morpholinyl)propoxy)phenyl)ethanone dihydrochloride, 1-[2,4-bis(2-hydroxy-3-morpholin-4-ium-4-ylpropoxy)phenyl]ethanone dichloride
| Molecular Formula | C22H36Cl2N2O7 |
| Molecular Weight | 510.18997 g/mol |
| XLogP | -8.79 |
| Topological Polar Surface Area (TPSA) | 103.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 510.18997 Da |
| Heavy Atoms | 33 |
| Complexity | 526.0 |
| SMILES | CC(=O)C1=C(C=C(C=C1)OCC(C[NH+]2CCOCC2)O)OCC(C[NH+]3CCOCC3)O.[Cl-].[Cl-] |
| InChIKey | VNQMKAHNUSPHMC-UHFFFAOYSA-N |
The XLogP value of -8.79 indicates that RefChem:341025 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:341025. Following Lipinski's Rule of Five, RefChem:341025 has 4 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of RefChem:341025 is 87049-18-1.
The molecular formula of RefChem:341025 is C22H36Cl2N2O7.
The molecular weight of RefChem:341025 is 510.18997 g/mol.
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