![Acetylthiamine [EP] structure](/static/products/1309/130967-52-1.webp)
Acetylthiamine [EP]
TL;DR: Acetylthiamine [EP] (CAS 130967-52-1) is a chemical compound with molecular formula C14H19N4O2S+ and molecular weight 307.12286 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl acetate
Also Known As: Acetylthiamine, Thiamine EP Impurity G, ACETYLTHIAMINE [EP], THIAMINE NITRATE IMPURITY G [EP IMPURITY], THIAMINE HYDROCHLORIDE IMPURITY G [EP IMPURITY]
Technical Specifications
| Molecular Formula | C14H19N4O2S+ |
| Molecular Weight | 307.12286 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 110.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 307.12286 Da |
| Heavy Atoms | 21 |
| Complexity | 358.0 |
| SMILES | CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCOC(=O)C |
| InChIKey | PDUYVBMLHXYKCF-UHFFFAOYSA-N |
Chemical Property Profile of Acetylthiamine [EP]
Property Insights of Acetylthiamine [EP]
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetylthiamine [EP]. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetylthiamine [EP]. Following Lipinski's Rule of Five, Acetylthiamine [EP] has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Acetylthiamine [EP]?
The CAS number of Acetylthiamine [EP] is 130967-52-1.
What is the molecular formula of Acetylthiamine [EP]?
The molecular formula of Acetylthiamine [EP] is C14H19N4O2S+.
What is the molecular weight of Acetylthiamine [EP]?
The molecular weight of Acetylthiamine [EP] is 307.12286 g/mol.
Where can I buy Acetylthiamine [EP]?
You can request a quote for Acetylthiamine [EP] directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acetylthiamine [EP]?
Yes, CoreyChem provides custom synthesis services for Acetylthiamine [EP] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.