4-(3,5-Dimethyl-1-pyridiniumyl)-5-formyl-1,3-thiazol-2-olate
TL;DR: 4-(3,5-Dimethyl-1-pyridiniumyl)-5-formyl-1,3-thiazol-2-olate (CAS 301298-07-7) is a chemical compound with molecular formula C11H10N2O2S and molecular weight 234.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3,5-dimethylpyridin-1-ium-1-yl)-5-formyl-1,3-thiazol-2-olate
Also Known As: BAS 00929321, 4-(3,5-dimethyl-1-pyridiniumyl)-5-formyl-1,3-thiazol-2-olate, 4-(3,5-dimethylpyridin-1-ium-1-yl)-5-formyl-2-oxothiazol-3-ide, 4-(3,5-dimethylpyridinium-1-yl)-5-formyl-2-oxo-1,3-thiazol-3-ide, 4-(3,5-dimethylpyridyl)-2-hydroxy-1,3-thiazole-5-carbaldehyde
| Molecular Formula | C11H10N2O2S |
|---|---|
| Molecular Weight | 234.05 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 85.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.0463 |
| Heavy Atoms | 16 |
| Complexity | 254.0 |
Chemical Identifiers
| CAS Number | 301298-07-7 |
|---|---|
| SMILES | CC1=CC(=C[N+](=C1)C2=C(SC(=N2)[O-])C=O)C |
| InChIKey | PHNYTDCHBSJPDS-UHFFFAOYSA-N |
Product Overview
4-(3,5-Dimethyl-1-pyridiniumyl)-5-formyl-1,3-thiazol-2-olate (CAS 301298-07-7), with molecular formula C11H10N2O2S and molecular weight 234.05 g/mol. IUPAC: 4-(3,5-dimethylpyridin-1-ium-1-yl)-5-formyl-1,3-thiazol-2-olate.
Chemical Property Profile of 4-(3,5-Dimethyl-1-pyridiniumyl)-5-formyl-1,3-thiazol-2-olate
Property Insights of 4-(3,5-Dimethyl-1-pyridiniumyl)-5-formyl-1,3-thiazol-2-olate
The XLogP value of 3.2 indicates that 4-(3,5-Dimethyl-1-pyridiniumyl)-5-formyl-1,3-thiazol-2-olate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(3,5-Dimethyl-1-pyridiniumyl)-5-formyl-1,3-thiazol-2-olate. Following Lipinski's Rule of Five, 4-(3,5-Dimethyl-1-pyridiniumyl)-5-formyl-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
Frequently Asked Questions
What is the CAS number of 4-(3,5-Dimethyl-1-pyridiniumyl)-5-formyl-1,3-thiazol-2-olate?
The CAS number of 4-(3,5-Dimethyl-1-pyridiniumyl)-5-formyl-1,3-thiazol-2-olate is 301298-07-7.
What is the molecular formula of 4-(3,5-Dimethyl-1-pyridiniumyl)-5-formyl-1,3-thiazol-2-olate?
The molecular formula of 4-(3,5-Dimethyl-1-pyridiniumyl)-5-formyl-1,3-thiazol-2-olate is C11H10N2O2S.
What is the molecular weight of 4-(3,5-Dimethyl-1-pyridiniumyl)-5-formyl-1,3-thiazol-2-olate?
The molecular weight of 4-(3,5-Dimethyl-1-pyridiniumyl)-5-formyl-1,3-thiazol-2-olate is 234.05 g/mol.
Where can I buy 4-(3,5-Dimethyl-1-pyridiniumyl)-5-formyl-1,3-thiazol-2-olate?
You can request a quote for 4-(3,5-Dimethyl-1-pyridiniumyl)-5-formyl-1,3-thiazol-2-olate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3,5-Dimethyl-1-pyridiniumyl)-5-formyl-1,3-thiazol-2-olate?
Yes, KEHONG BIO provides custom synthesis services for 4-(3,5-Dimethyl-1-pyridiniumyl)-5-formyl-1,3-thiazol-2-olate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.