Thiazole-4-carboxylic acid, 2-(5-nitro-2-thienyl)-
TL;DR: Thiazole-4-carboxylic acid, 2-(5-nitro-2-thienyl)- (CAS 56527-65-2) is a chemical compound with molecular formula C8H4N2O4S2 and molecular weight 255.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-nitrothiophen-2-yl)-1,3-thiazole-4-carboxylic acid
Also Known As: 4-thiazolecarboxylic acid, 2-(5-nitro-2-thienyl)-, 2,2'-Diacetylamino-4,4'-bis-thiazole, Thiazole-4-carboxylic acid, 2-(5-nitro-2-thienyl)-, 2-(5-Nitro-2-thienyl)-4-thiazolecarboxylic acid, 2-(5-Nitrothiophen-2-yl)thiazole-4-carboxylic acid
| Molecular Formula | C8H4N2O4S2 |
|---|---|
| Molecular Weight | 255.96 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 152.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 255.96124 |
| Heavy Atoms | 16 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 56527-65-2 |
|---|---|
| SMILES | C1=C(SC(=C1)[N+](=O)[O-])C2=NC(=CS2)C(=O)O |
| InChIKey | SNNIGNLXYVEYOC-UHFFFAOYSA-N |
Product Overview
Thiazole-4-carboxylic acid, 2-(5-nitro-2-thienyl)- (CAS 56527-65-2), with molecular formula C8H4N2O4S2 and molecular weight 255.96 g/mol. IUPAC: 2-(5-nitrothiophen-2-yl)-1,3-thiazole-4-carboxylic acid.
Chemical Property Profile of Thiazole-4-carboxylic acid, 2-(5-nitro-2-thienyl)-
Property Insights of Thiazole-4-carboxylic acid, 2-(5-nitro-2-thienyl)-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thiazole-4-carboxylic acid, 2-(5-nitro-2-thienyl)-. The TPSA of 152.0 Ų indicates high polarity, suggesting Thiazole-4-carboxylic acid, 2-(5-nitro-2-thienyl)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Thiazole-4-carboxylic acid, 2-(5-nitro-2-thienyl)- has 1 hydrogen bond donor(s) and 7 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 Thiazole-4-carboxylic acid, 2-(5-nitro-2-thienyl)-?
The CAS number of Thiazole-4-carboxylic acid, 2-(5-nitro-2-thienyl)- is 56527-65-2.
What is the molecular formula of Thiazole-4-carboxylic acid, 2-(5-nitro-2-thienyl)-?
The molecular formula of Thiazole-4-carboxylic acid, 2-(5-nitro-2-thienyl)- is C8H4N2O4S2.
What is the molecular weight of Thiazole-4-carboxylic acid, 2-(5-nitro-2-thienyl)-?
The molecular weight of Thiazole-4-carboxylic acid, 2-(5-nitro-2-thienyl)- is 255.96 g/mol.
Where can I buy Thiazole-4-carboxylic acid, 2-(5-nitro-2-thienyl)-?
You can request a quote for Thiazole-4-carboxylic acid, 2-(5-nitro-2-thienyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiazole-4-carboxylic acid, 2-(5-nitro-2-thienyl)-?
Yes, KEHONG BIO provides custom synthesis services for Thiazole-4-carboxylic acid, 2-(5-nitro-2-thienyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.