5-Formyl-4-(4-methylpyridinium-1-yl)-1,3-thiazol-2-olate
TL;DR: 5-Formyl-4-(4-methylpyridinium-1-yl)-1,3-thiazol-2-olate (CAS 127868-42-2) is a chemical compound with molecular formula C10H8N2O2S and molecular weight 220.03065 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-formyl-4-(4-methylpyridin-1-ium-1-yl)-1,3-thiazol-2-olate
Also Known As: BAS 00929317, SDCCGMLS-0064835.P001, 5-formyl-4-(4-methylpyridinium-1-yl)-1,3-thiazol-2-olate, AE-848/31938042, 5-formyl-4-(4-methylpyridin-1-ium-1-yl)-1,3-thiazol-2-olate
Technical Specifications
| Molecular Formula | C10H8N2O2S |
| Molecular Weight | 220.03065 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 85.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.03065 Da |
| Heavy Atoms | 15 |
| Complexity | 231.0 |
| SMILES | CC1=CC=[N+](C=C1)C2=C(SC(=N2)[O-])C=O |
| InChIKey | LOHWHSHMOQCHAG-UHFFFAOYSA-N |
Chemical Property Profile of 5-Formyl-4-(4-methylpyridinium-1-yl)-1,3-thiazol-2-olate
Property Insights of 5-Formyl-4-(4-methylpyridinium-1-yl)-1,3-thiazol-2-olate
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Formyl-4-(4-methylpyridinium-1-yl)-1,3-thiazol-2-olate. The TPSA of 85.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Formyl-4-(4-methylpyridinium-1-yl)-1,3-thiazol-2-olate. Following Lipinski's Rule of Five, 5-Formyl-4-(4-methylpyridinium-1-yl)-1,3-thiazol-2-olate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-Formyl-4-(4-methylpyridinium-1-yl)-1,3-thiazol-2-olate?
The CAS number of 5-Formyl-4-(4-methylpyridinium-1-yl)-1,3-thiazol-2-olate is 127868-42-2.
What is the molecular formula of 5-Formyl-4-(4-methylpyridinium-1-yl)-1,3-thiazol-2-olate?
The molecular formula of 5-Formyl-4-(4-methylpyridinium-1-yl)-1,3-thiazol-2-olate is C10H8N2O2S.
What is the molecular weight of 5-Formyl-4-(4-methylpyridinium-1-yl)-1,3-thiazol-2-olate?
The molecular weight of 5-Formyl-4-(4-methylpyridinium-1-yl)-1,3-thiazol-2-olate is 220.03065 g/mol.
Where can I buy 5-Formyl-4-(4-methylpyridinium-1-yl)-1,3-thiazol-2-olate?
You can request a quote for 5-Formyl-4-(4-methylpyridinium-1-yl)-1,3-thiazol-2-olate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Formyl-4-(4-methylpyridinium-1-yl)-1,3-thiazol-2-olate?
Yes, CoreyChem provides custom synthesis services for 5-Formyl-4-(4-methylpyridinium-1-yl)-1,3-thiazol-2-olate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.