4-甲基-2-苯基-5-噻唑乙酸
TL;DR: 4-甲基-2-苯基-5-噻唑乙酸 (CAS 54225-72-8) is a chemical compound with molecular formula C12H11NO2S and molecular weight 233.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-甲基-2-苯基-5-噻唑乙酸
2-(4-methyl-2-phenyl-1,3-thiazol-5-yl)acetic acid
Also Known As: (4-METHYL-2-PHENYL-1,3-THIAZOL-5-YL)ACETIC ACID, 4-Methyl-2-phenyl-5-thiazoleacetic acid, 5-Thiazoleacetic acid, 4-methyl-2-phenyl-, 2-(4-methyl-2-phenyl-1,3-thiazol-5-yl)acetic acid, 4-27-00-04094 (Beilstein Handbook Reference)
| Molecular Formula | C12H11NO2S |
|---|---|
| Molecular Weight | 233.05 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 78.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.05106 |
| Heavy Atoms | 16 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 54225-72-8 |
|---|---|
| SMILES | CC1=C(SC(=N1)C2=CC=CC=C2)CC(=O)O |
| InChIKey | RWYONVYVVYSLDV-UHFFFAOYSA-N |
Product Overview
4-甲基-2-苯基-5-噻唑乙酸 (CAS 54225-72-8), with molecular formula C12H11NO2S and molecular weight 233.05 g/mol. IUPAC: 2-(4-methyl-2-phenyl-1,3-thiazol-5-yl)acetic acid.
Chemical Property Profile of 4-甲基-2-苯基-5-噻唑乙酸
Property Insights of 4-甲基-2-苯基-5-噻唑乙酸
The XLogP value of 3.3 indicates that 4-甲基-2-苯基-5-噻唑乙酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-甲基-2-苯基-5-噻唑乙酸. Following Lipinski's Rule of Five, 4-甲基-2-苯基-5-噻唑乙酸 has 1 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-甲基-2-苯基-5-噻唑乙酸?
The CAS number of 4-甲基-2-苯基-5-噻唑乙酸 is 54225-72-8.
What is the molecular formula of 4-甲基-2-苯基-5-噻唑乙酸?
The molecular formula of 4-甲基-2-苯基-5-噻唑乙酸 is C12H11NO2S.
What is the molecular weight of 4-甲基-2-苯基-5-噻唑乙酸?
The molecular weight of 4-甲基-2-苯基-5-噻唑乙酸 is 233.05 g/mol.
Where can I buy 4-甲基-2-苯基-5-噻唑乙酸?
You can request a quote for 4-甲基-2-苯基-5-噻唑乙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-甲基-2-苯基-5-噻唑乙酸?
Yes, KEHONG BIO provides custom synthesis services for 4-甲基-2-苯基-5-噻唑乙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.