TL;DR: Duranest (CAS 36637-19-1) is a chemical compound with molecular formula C17H29ClN2O and molecular weight 312.19684 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[1-(2,6-dimethylanilino)-1-oxobutan-2-yl]-ethyl-propylazanium chloride
Also Known As: Duranest, Etidocaine hydrochloride, Etidocaine HCl, W 19053, W-19053
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C17H29ClN2O |
| Molecular Weight | 312.19684 g/mol |
| XLogP | -0.66 |
| Topological Polar Surface Area (TPSA) | 33.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 312.19684 Da |
| Heavy Atoms | 21 |
| Complexity | 283.0 |
| SMILES | CCC[NH+](CC)C(CC)C(=O)NC1=C(C=CC=C1C)C.[Cl-] |
| InChIKey | LMWQQUMMGGIGJQ-UHFFFAOYSA-N |
The XLogP value of -0.66 indicates that Duranest is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 33.5 Ų, Duranest exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Duranest has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Duranest is 36637-19-1.
The molecular formula of Duranest is C17H29ClN2O.
The molecular weight of Duranest is 312.19684 g/mol.
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