Acefurtiamine
TL;DR: Acefurtiamine (CAS 10072-48-7) is a chemical compound with molecular formula C21H24N4O7S and molecular weight 476.13657 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-[(4-amino-2-methylpyrimidin-5-yl)methyl-formylamino]-3-(furan-2-carbonylsulfanyl)pent-3-enyl] 2-acetyloxyacetate
Also Known As: Acefurtiamine, Acefurtiamina, Acefurtiaminum, Acefurtiamine [INN], [4-[(4-amino-2-methylpyrimidin-5-yl)methyl-formylamino]-3-(furan-2-carbonylsulfanyl)pent-3-enyl] 2-acetyloxyacetate
Technical Specifications
| Molecular Formula | C21H24N4O7S |
| Molecular Weight | 476.13657 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 180.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 13 |
| Exact Mass | 476.13657 Da |
| Heavy Atoms | 33 |
| Complexity | 748.0 |
| SMILES | CC1=NC=C(C(=N1)N)CN(C=O)C(=C(CCOC(=O)COC(=O)C)SC(=O)C2=CC=CO2)C |
| InChIKey | MYBUGVXNAHWTOL-UHFFFAOYSA-N |
Product Description
Applications: Acefurtiamine is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Acefurtiamine (CAS 10072-48-7) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Acefurtiamine (CAS 10072-48-7) is a fine chemical with the molecular formula C21H24N4O7S and a molecular weight of 476.14 g/mol. It is also known as Acefurtiamine and Acefurtiamina.
CoreyChem provides it with COA documentation, and custom synthesis from milligram to multi-kilogram scales is available on request. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Acefurtiamine
Property Insights of Acefurtiamine
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acefurtiamine. The TPSA of 180.0 Ų indicates high polarity, suggesting Acefurtiamine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Acefurtiamine has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Acefurtiamine?
The CAS number of Acefurtiamine is 10072-48-7.
What is the molecular formula of Acefurtiamine?
The molecular formula of Acefurtiamine is C21H24N4O7S.
What is the molecular weight of Acefurtiamine?
The molecular weight of Acefurtiamine is 476.13657 g/mol.
What are the applications of Acefurtiamine?
Acefurtiamine is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Acefurtiamine (CAS 10072-48-7) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and...
Where can I buy Acefurtiamine?
You can request a quote for Acefurtiamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acefurtiamine?
Yes, CoreyChem provides custom synthesis services for Acefurtiamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.