TL;DR: Acetamide, N-(2-(acetylamino)-3-thienyl)-N-(2-(dimethylamino)ethyl)-, monohydrochloride (CAS 122777-82-6) is a chemical compound with molecular formula C12H20ClN3O2S and molecular weight 305.09647 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[3-[acetyl-[2-(dimethylamino)ethyl]amino]thiophen-2-yl]acetamide;hydrochloride
Also Known As: Acetamide, N-(2-(acetylamino)-3-thienyl)-N-(2-(dimethylamino)ethyl)-, monohydrochloride, N-(2-(Acetylamino)-3-thienyl)-N-(2-(dimethylamino)ethyl)acetamide hydrochloride, N-[3-[acetyl-[2-(dimethylamino)ethyl]amino]thiophen-2-yl]acetamide, Acetamide,N-(2-(acetylamino)-3-thienyl)-N-(2-(dimethylamino)ethyl)-hcl, ACETAMIDE,N-(2-(ACETYLAMINO)-3-THIENYL)-N-(2-(DIMETHYLAMINO)ETHYL)- HCL
| Molecular Formula | C12H20ClN3O2S |
| Molecular Weight | 305.09647 g/mol |
| XLogP | 2.0428 |
| Topological Polar Surface Area (TPSA) | 80.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 305.09647 Da |
| Heavy Atoms | 19 |
| Complexity | 310.0 |
| SMILES | CC(=O)NC1=C(C=CS1)N(CCN(C)C)C(=O)C.Cl |
| InChIKey | QNDRHERDCRTMHS-UHFFFAOYSA-N |
The XLogP value of 2.0428 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetamide, N-(2-(acetylamino)-3-thienyl)-N-(2-(dimethylamino)ethyl)-, monohydrochloride. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetamide, N-(2-(acetylamino)-3-thienyl)-N-(2-(dimethylamino)ethyl)-, monohydrochloride. Following Lipinski's Rule of Five, Acetamide, N-(2-(acetylamino)-3-thienyl)-N-(2-(dimethylamino)ethyl)-, monohydrochloride has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Acetamide, N-(2-(acetylamino)-3-thienyl)-N-(2-(dimethylamino)ethyl)-, monohydrochloride is 122777-82-6.
The molecular formula of Acetamide, N-(2-(acetylamino)-3-thienyl)-N-(2-(dimethylamino)ethyl)-, monohydrochloride is C12H20ClN3O2S.
The molecular weight of Acetamide, N-(2-(acetylamino)-3-thienyl)-N-(2-(dimethylamino)ethyl)-, monohydrochloride is 305.09647 g/mol.
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