Benzoic acid, 2-methoxy-5-(4-methyl-2-thiazolyl)-
TL;DR: Benzoic acid, 2-methoxy-5-(4-methyl-2-thiazolyl)- (CAS 39906-04-2) is a chemical compound with molecular formula C12H11NO3S and molecular weight 249.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxy-5-(4-methyl-1,3-thiazol-2-yl)benzoic acid
Also Known As: 2-Methoxy-5-(4-methyl-2-thiazolyl)benzoic acid, Benzoic acid, 2-methoxy-5-(4-methyl-2-thiazolyl)-, 2-methoxy-5-(4-methyl-1,3-thiazol-2-yl)benzoic acid, 5-(4-Methyl-2-thiazolyl)-2-methoxy-benzoesaeure, 5-(4-Methyl-2-thiazolyl)-2-methoxy-benzoesaeure [German]
| Molecular Formula | C12H11NO3S |
|---|---|
| Molecular Weight | 249.05 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 87.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.04596 |
| Heavy Atoms | 17 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 39906-04-2 |
|---|---|
| SMILES | CC1=CSC(=N1)C2=CC(=C(C=C2)OC)C(=O)O |
| InChIKey | XSWNMPLWRXIFNW-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 2-methoxy-5-(4-methyl-2-thiazolyl)- (CAS 39906-04-2), with molecular formula C12H11NO3S and molecular weight 249.05 g/mol. IUPAC: 2-methoxy-5-(4-methyl-1,3-thiazol-2-yl)benzoic acid.
Chemical Property Profile of Benzoic acid, 2-methoxy-5-(4-methyl-2-thiazolyl)-
Property Insights of Benzoic acid, 2-methoxy-5-(4-methyl-2-thiazolyl)-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 2-methoxy-5-(4-methyl-2-thiazolyl)-. The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 2-methoxy-5-(4-methyl-2-thiazolyl)-. Following Lipinski's Rule of Five, Benzoic acid, 2-methoxy-5-(4-methyl-2-thiazolyl)- has 1 hydrogen bond donor(s) and 5 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 Benzoic acid, 2-methoxy-5-(4-methyl-2-thiazolyl)-?
The CAS number of Benzoic acid, 2-methoxy-5-(4-methyl-2-thiazolyl)- is 39906-04-2.
What is the molecular formula of Benzoic acid, 2-methoxy-5-(4-methyl-2-thiazolyl)-?
The molecular formula of Benzoic acid, 2-methoxy-5-(4-methyl-2-thiazolyl)- is C12H11NO3S.
What is the molecular weight of Benzoic acid, 2-methoxy-5-(4-methyl-2-thiazolyl)-?
The molecular weight of Benzoic acid, 2-methoxy-5-(4-methyl-2-thiazolyl)- is 249.05 g/mol.
Where can I buy Benzoic acid, 2-methoxy-5-(4-methyl-2-thiazolyl)-?
You can request a quote for Benzoic acid, 2-methoxy-5-(4-methyl-2-thiazolyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-methoxy-5-(4-methyl-2-thiazolyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-methoxy-5-(4-methyl-2-thiazolyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.