TL;DR: RefChem:1061760 (CAS 63917-31-7) is a chemical compound with molecular formula C13H21ClN2O and molecular weight 256.13425 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]azanium chloride
Also Known As: Dimethylaminoacetyl 2,4,6-trimethylaniline hydrochloride, 2-(Dimethylamino)-2',4',6'-trimethylacetanilide hydrochloride, ACETANILIDE, 2-(DIMETHYLAMINO)-2',4',6'-TRIMETHYL-, HYDROCHLORIDE, dimethyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]azanium chloride, Acetamide, 2-(dimethylamino)-N-(2,4,6-trimethylphenyl)-, monohydrochloride
| Molecular Formula | C13H21ClN2O |
| Molecular Weight | 256.13425 g/mol |
| XLogP | -2.3 |
| Topological Polar Surface Area (TPSA) | 33.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.13425 Da |
| Heavy Atoms | 17 |
| Complexity | 228.0 |
| SMILES | CC1=CC(=C(C(=C1)C)NC(=O)C[NH+](C)C)C.[Cl-] |
| InChIKey | UXFAOKRQPWHNEM-UHFFFAOYSA-N |
The XLogP value of -2.3 indicates that RefChem:1061760 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, RefChem:1061760 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1061760 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 RefChem:1061760 is 63917-31-7.
The molecular formula of RefChem:1061760 is C13H21ClN2O.
The molecular weight of RefChem:1061760 is 256.13425 g/mol.
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