3-(5-Amino-1,3,4-thiadiazol-2-yl)propanoic acid
TL;DR: 3-(5-Amino-1,3,4-thiadiazol-2-yl)propanoic acid (CAS 66030-27-1) is a chemical compound with molecular formula C5H7N3O2S and molecular weight 173.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5-amino-1,3,4-thiadiazol-2-yl)propanoic acid
Also Known As: 3-(5-Amino-1,3,4-thiadiazol-2-yl)propanoic acid, 3-(5-Amino-[1,3,4]thiadiazol-2-yl)-propionic acid, BAS 10153181, 3-(amino-[1,3,4]thiadiazol-2-yl)-propionic acid, 5-Amino-1,3,4-thiadiazole-2-propionic acid
| Molecular Formula | C5H7N3O2S |
|---|---|
| Molecular Weight | 173.03 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 173.0259 |
| Heavy Atoms | 11 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 66030-27-1 |
|---|---|
| SMILES | C(CC(=O)O)C1=NN=C(S1)N |
| InChIKey | RTWZBJXCDVCSSL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(5-Amino-1,3,4-thiadiazol-2-yl)propanoic acid (CAS 66030-27-1), with molecular formula C5H7N3O2S and molecular weight 173.03 g/mol. IUPAC: 3-(5-amino-1,3,4-thiadiazol-2-yl)propanoic acid.
Chemical Property Profile of 3-(5-Amino-1,3,4-thiadiazol-2-yl)propanoic acid
Property Insights of 3-(5-Amino-1,3,4-thiadiazol-2-yl)propanoic acid
The XLogP value of -0.2 indicates that 3-(5-Amino-1,3,4-thiadiazol-2-yl)propanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(5-Amino-1,3,4-thiadiazol-2-yl)propanoic acid. Following Lipinski's Rule of Five, 3-(5-Amino-1,3,4-thiadiazol-2-yl)propanoic acid has 2 hydrogen bond donor(s) and 6 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-(5-Amino-1,3,4-thiadiazol-2-yl)propanoic acid?
The CAS number of 3-(5-Amino-1,3,4-thiadiazol-2-yl)propanoic acid is 66030-27-1.
What is the molecular formula of 3-(5-Amino-1,3,4-thiadiazol-2-yl)propanoic acid?
The molecular formula of 3-(5-Amino-1,3,4-thiadiazol-2-yl)propanoic acid is C5H7N3O2S.
What is the molecular weight of 3-(5-Amino-1,3,4-thiadiazol-2-yl)propanoic acid?
The molecular weight of 3-(5-Amino-1,3,4-thiadiazol-2-yl)propanoic acid is 173.03 g/mol.
Where can I buy 3-(5-Amino-1,3,4-thiadiazol-2-yl)propanoic acid?
You can request a quote for 3-(5-Amino-1,3,4-thiadiazol-2-yl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(5-Amino-1,3,4-thiadiazol-2-yl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(5-Amino-1,3,4-thiadiazol-2-yl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.