Thiamin,Jodid
TL;DR: Thiamin,Jodid (CAS 33232-06-3) is a chemical compound with molecular formula C12H17IN4OS and molecular weight 392.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol iodide
Also Known As: Thiamin,Jodid, 3-[methyl]-5-4-methylthiazoliumiodide, 3-[ methyl]-5- -4-methylthiazoliumiodide, 3-((4-Amino-2-methylpyrimidin-5-yl)methyl)-5-(2-hydroxyethyl)-4-methylthiazolium iodide, 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium iodide
| Molecular Formula | C12H17IN4OS |
|---|---|
| Molecular Weight | 392.02 g/mol |
| LogP | -2.39 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 392.01678 |
| Heavy Atoms | 19 |
| Complexity | 268.0 |
Chemical Identifiers
| CAS Number | 33232-06-3 |
|---|---|
| SMILES | CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.[I-] |
| InChIKey | OJCWGTRLOGXKRQ-UHFFFAOYSA-M |
Product Overview
Thiamin,Jodid (CAS 33232-06-3), with molecular formula C12H17IN4OS and molecular weight 392.02 g/mol. IUPAC: 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol iodide.
Chemical Property Profile of Thiamin,Jodid
Property Insights of Thiamin,Jodid
The XLogP value of -2.39 indicates that Thiamin,Jodid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Thiamin,Jodid. Following Lipinski's Rule of Five, Thiamin,Jodid has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Thiamin,Jodid?
The CAS number of Thiamin,Jodid is 33232-06-3.
What is the molecular formula of Thiamin,Jodid?
The molecular formula of Thiamin,Jodid is C12H17IN4OS.
What is the molecular weight of Thiamin,Jodid?
The molecular weight of Thiamin,Jodid is 392.02 g/mol.
Where can I buy Thiamin,Jodid?
You can request a quote for Thiamin,Jodid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiamin,Jodid?
Yes, KEHONG BIO provides custom synthesis services for Thiamin,Jodid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.