3-Methyl-2-phenyl-1,3-thiazol-3-ium-5-olate
TL;DR: 3-Methyl-2-phenyl-1,3-thiazol-3-ium-5-olate (CAS 1280-28-0) is a chemical compound with molecular formula C10H9NOS and molecular weight 191.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-2-phenyl-1,3-thiazol-3-ium-5-olate
Also Known As: 3-Methyl-2-phenyl-1,3-thiazol-3-ium-5-olate, 3-methyl-2-phenyl-1,3-thiazol-5-olate, 3-Methyl-2-phenylthiazol-3-ium-5-olate, Thiazolium, 5-hydroxy-3-methyl-2-phenyl-, hydroxide, inner salt, RefChem:280800
| Molecular Formula | C10H9NOS |
|---|---|
| Molecular Weight | 191.04 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 55.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 191.04048 |
| Heavy Atoms | 13 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 1280-28-0 |
|---|---|
| SMILES | C[N+]1=C(SC(=C1)[O-])C2=CC=CC=C2 |
| InChIKey | GQTWYTCXPUSYNI-UHFFFAOYSA-N |
Product Overview
3-Methyl-2-phenyl-1,3-thiazol-3-ium-5-olate (CAS 1280-28-0), with molecular formula C10H9NOS and molecular weight 191.04 g/mol. IUPAC: 3-methyl-2-phenyl-1,3-thiazol-3-ium-5-olate.
Chemical Property Profile of 3-Methyl-2-phenyl-1,3-thiazol-3-ium-5-olate
Property Insights of 3-Methyl-2-phenyl-1,3-thiazol-3-ium-5-olate
The XLogP value of 3.4 indicates that 3-Methyl-2-phenyl-1,3-thiazol-3-ium-5-olate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.2 Ų, 3-Methyl-2-phenyl-1,3-thiazol-3-ium-5-olate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-2-phenyl-1,3-thiazol-3-ium-5-olate has 0 hydrogen bond donor(s) and 2 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 3-Methyl-2-phenyl-1,3-thiazol-3-ium-5-olate?
The CAS number of 3-Methyl-2-phenyl-1,3-thiazol-3-ium-5-olate is 1280-28-0.
What is the molecular formula of 3-Methyl-2-phenyl-1,3-thiazol-3-ium-5-olate?
The molecular formula of 3-Methyl-2-phenyl-1,3-thiazol-3-ium-5-olate is C10H9NOS.
What is the molecular weight of 3-Methyl-2-phenyl-1,3-thiazol-3-ium-5-olate?
The molecular weight of 3-Methyl-2-phenyl-1,3-thiazol-3-ium-5-olate is 191.04 g/mol.
Where can I buy 3-Methyl-2-phenyl-1,3-thiazol-3-ium-5-olate?
You can request a quote for 3-Methyl-2-phenyl-1,3-thiazol-3-ium-5-olate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-2-phenyl-1,3-thiazol-3-ium-5-olate?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-2-phenyl-1,3-thiazol-3-ium-5-olate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.