TL;DR: 2-(4-(1-(Furan-2-ylmethyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate (CAS 1048346-94-6) is a chemical compound with molecular formula C18H29N3O6 and molecular weight 383.20563 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-[1-(furan-2-ylmethyl)piperidin-4-yl]piperazin-1-yl]ethanol;oxalic acid
Also Known As: 2-(4-(1-(furan-2-ylmethyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate, 2-[4-[1-(furan-2-ylmethyl)piperidin-4-yl]piperazin-1-yl]ethanol; oxalic acid, IUPAC: 2-[4-[1-(2-furylmethyl)-4-piperidyl]piperazin-1-yl]ethanol; Oxalic Acid
| Molecular Formula | C18H29N3O6 |
| Molecular Weight | 383.20563 g/mol |
| XLogP | 0.0095 |
| Topological Polar Surface Area (TPSA) | 118.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 383.20563 Da |
| Heavy Atoms | 27 |
| Complexity | 371.0 |
| SMILES | C1CN(CCC1N2CCN(CC2)CCO)CC3=CC=CO3.C(=O)(C(=O)O)O |
| InChIKey | CJAZLWVQMSWWLQ-UHFFFAOYSA-N |
The XLogP value of 0.0095 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-(1-(Furan-2-ylmethyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-(1-(Furan-2-ylmethyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate. Following Lipinski's Rule of Five, 2-(4-(1-(Furan-2-ylmethyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-(4-(1-(Furan-2-ylmethyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate is 1048346-94-6.
The molecular formula of 2-(4-(1-(Furan-2-ylmethyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate is C18H29N3O6.
The molecular weight of 2-(4-(1-(Furan-2-ylmethyl)piperidin-4-yl)piperazin-1-yl)ethanol oxalate is 383.20563 g/mol.
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