TL;DR: 2-(3-Carbamoylpentan-3-ylsulfanyl)hexanamide (CAS 103798-05-6) is a chemical compound with molecular formula C12H24N2O2S and molecular weight 260.15585 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-carbamoylpentan-3-ylsulfanyl)hexanamide
Also Known As: 2-(3-carbamoylpentan-3-ylsulfanyl)hexanamide, 2-[(3-carbamoylpentan-3-yl)sulfanyl]hexanamide, 2-ethyl-2-(1-carbamoyl-pentylsulfanyl)-butyric acid amide
| Molecular Formula | C12H24N2O2S |
| Molecular Weight | 260.15585 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 111.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 260.15585 Da |
| Heavy Atoms | 17 |
| Complexity | 265.0 |
| SMILES | CCCCC(C(=O)N)SC(CC)(CC)C(=O)N |
| InChIKey | OEZALBUUKUDJTR-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Carbamoylpentan-3-ylsulfanyl)hexanamide. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Carbamoylpentan-3-ylsulfanyl)hexanamide. Following Lipinski's Rule of Five, 2-(3-Carbamoylpentan-3-ylsulfanyl)hexanamide 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 2-(3-Carbamoylpentan-3-ylsulfanyl)hexanamide is 103798-05-6.
The molecular formula of 2-(3-Carbamoylpentan-3-ylsulfanyl)hexanamide is C12H24N2O2S.
The molecular weight of 2-(3-Carbamoylpentan-3-ylsulfanyl)hexanamide is 260.15585 g/mol.
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