TL;DR: VU0494423-1 (CAS 1052421-94-9) is a chemical compound with molecular formula C19H29ClN2O5 and molecular weight 400.1765 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 4-[2-hydroxy-3-(4-propanoylphenoxy)propyl]piperazine-1-carboxylate;hydrochloride
Also Known As: VU0494423-1, F1674-0049, Ethyl 4-[2-hydroxy-3-(4-propanoylphenoxy)propyl]piperazine-1-carboxylate Hydrochloride, ethyl 4-(2-hydroxy-3-(4-propionylphenoxy)propyl)piperazine-1-carboxylate hydrochloride, ethyl 4-[2-hydroxy-3-(4-propanoylphenoxy)propyl]piperazine-1-carboxylate;hydrochloride
| Molecular Formula | C19H29ClN2O5 |
| Molecular Weight | 400.1765 g/mol |
| XLogP | 2.2149 |
| Topological Polar Surface Area (TPSA) | 79.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 400.1765 Da |
| Heavy Atoms | 27 |
| Complexity | 443.0 |
| SMILES | CCC(=O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)C(=O)OCC)O.Cl |
| InChIKey | GNBWYNHUGPTRHG-UHFFFAOYSA-N |
The XLogP value of 2.2149 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0494423-1. The TPSA of 79.3 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0494423-1. Following Lipinski's Rule of Five, VU0494423-1 has 2 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 VU0494423-1 is 1052421-94-9.
The molecular formula of VU0494423-1 is C19H29ClN2O5.
The molecular weight of VU0494423-1 is 400.1765 g/mol.
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