delta(3)-Thiazoline-4-carboxylate
TL;DR: delta(3)-Thiazoline-4-carboxylate (CAS 94406-11-8) is a chemical compound with molecular formula C4H5NO2S and molecular weight 131.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dihydro-1,3-thiazole-4-carboxylic acid
Also Known As: delta(3)-Thiazoline-4-carboxylate, delta -thiazoline-4-carboxylate, 2,5-dihydro-1,3-thiazole-4-carboxylic acid, 2,5-Dihydrothiazole-4-carboxylic acid, 4-Thiazolecarboxylicacid, 2,5-dihydro-
| Molecular Formula | C4H5NO2S |
|---|---|
| Molecular Weight | 131.00 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 75.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 131.0041 |
| Heavy Atoms | 8 |
| Complexity | 143.0 |
Chemical Identifiers
| CAS Number | 94406-11-8 |
|---|---|
| SMILES | C1C(=NCS1)C(=O)O |
| InChIKey | IREQLINHYFEKMU-UHFFFAOYSA-N |
Product Overview
delta(3)-Thiazoline-4-carboxylate (CAS 94406-11-8), with molecular formula C4H5NO2S and molecular weight 131.00 g/mol. IUPAC: 2,5-dihydro-1,3-thiazole-4-carboxylic acid.
Chemical Property Profile of delta(3)-Thiazoline-4-carboxylate
Property Insights of delta(3)-Thiazoline-4-carboxylate
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for delta(3)-Thiazoline-4-carboxylate. The TPSA of 75.0 Ų falls within the moderate polarity range, balancing permeability and solubility for delta(3)-Thiazoline-4-carboxylate. Following Lipinski's Rule of Five, delta(3)-Thiazoline-4-carboxylate 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 delta(3)-Thiazoline-4-carboxylate?
The CAS number of delta(3)-Thiazoline-4-carboxylate is 94406-11-8.
What is the molecular formula of delta(3)-Thiazoline-4-carboxylate?
The molecular formula of delta(3)-Thiazoline-4-carboxylate is C4H5NO2S.
What is the molecular weight of delta(3)-Thiazoline-4-carboxylate?
The molecular weight of delta(3)-Thiazoline-4-carboxylate is 131.00 g/mol.
Where can I buy delta(3)-Thiazoline-4-carboxylate?
You can request a quote for delta(3)-Thiazoline-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for delta(3)-Thiazoline-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for delta(3)-Thiazoline-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.