TL;DR: RefChem:1056342 (CAS 101491-67-2) is a chemical compound with molecular formula C15H25ClN2O2 and molecular weight 300.16046 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
diethyl-[2-(1-phenylethoxycarbonylamino)ethyl]azanium chloride
Also Known As: alpha-Methylbenzyl N-(2-(diethylamino)ethyl)carbamate hydrochloride, diethyl-[2-(1-phenylethoxycarbonylamino)ethyl]azanium chloride, d-alpha-Methylbenzyl N-(2-(diethylamino)ethyl)carbamate hydrochloride, diethyl-[2-(1-phenylethoxycarbonylamino)ethyl]azanium, diethyl-[2-(1-phenylethoxycarbonylamino)ethyl]azanium;chloride
| Molecular Formula | C15H25ClN2O2 |
| Molecular Weight | 300.16046 g/mol |
| XLogP | -1.6 |
| Topological Polar Surface Area (TPSA) | 42.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 300.16046 Da |
| Heavy Atoms | 20 |
| Complexity | 249.0 |
| SMILES | CC[NH+](CC)CCNC(=O)OC(C)C1=CC=CC=C1.[Cl-] |
| InChIKey | JOFXZHOHDBVQQS-UHFFFAOYSA-N |
The XLogP value of -1.6 indicates that RefChem:1056342 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 42.8 Ų, RefChem:1056342 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1056342 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of RefChem:1056342 is 101491-67-2.
The molecular formula of RefChem:1056342 is C15H25ClN2O2.
The molecular weight of RefChem:1056342 is 300.16046 g/mol.
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