TL;DR: 2-((5-(5-aminopentyl)-1,3,4-oxadiazol-2-yl)thio)-N-(3-chlorophenyl)acetamide hydrochloride (CAS 1052521-75-1) is a chemical compound with molecular formula C15H20Cl2N4O2S and molecular weight 390.0684 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[5-(5-aminopentyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(3-chlorophenyl)acetamide;hydrochloride
Also Known As: 2-((5-(5-aminopentyl)-1,3,4-oxadiazol-2-yl)thio)-N-(3-chlorophenyl)acetamide hydrochloride, 2-[[5-(5-aminopentyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(3-chlorophenyl)acetamide hydrochloride
| Molecular Formula | C15H20Cl2N4O2S |
| Molecular Weight | 390.0684 g/mol |
| XLogP | 3.5471 |
| Topological Polar Surface Area (TPSA) | 119.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 390.0684 Da |
| Heavy Atoms | 24 |
| Complexity | 364.0 |
| SMILES | C1=CC(=CC(=C1)Cl)NC(=O)CSC2=NN=C(O2)CCCCCN.Cl |
| InChIKey | PEGNKGICDFJKAH-UHFFFAOYSA-N |
The XLogP value of 3.5471 indicates that 2-((5-(5-aminopentyl)-1,3,4-oxadiazol-2-yl)thio)-N-(3-chlorophenyl)acetamide hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((5-(5-aminopentyl)-1,3,4-oxadiazol-2-yl)thio)-N-(3-chlorophenyl)acetamide hydrochloride. Following Lipinski's Rule of Five, 2-((5-(5-aminopentyl)-1,3,4-oxadiazol-2-yl)thio)-N-(3-chlorophenyl)acetamide hydrochloride has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-((5-(5-aminopentyl)-1,3,4-oxadiazol-2-yl)thio)-N-(3-chlorophenyl)acetamide hydrochloride is 1052521-75-1.
The molecular formula of 2-((5-(5-aminopentyl)-1,3,4-oxadiazol-2-yl)thio)-N-(3-chlorophenyl)acetamide hydrochloride is C15H20Cl2N4O2S.
The molecular weight of 2-((5-(5-aminopentyl)-1,3,4-oxadiazol-2-yl)thio)-N-(3-chlorophenyl)acetamide hydrochloride is 390.0684 g/mol.
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