(2S)-2-azaniumyl-3-(1,3-thiazol-2-yl)propanoate
TL;DR: (2S)-2-azaniumyl-3-(1,3-thiazol-2-yl)propanoate (CAS 1596-65-2) is a chemical compound with molecular formula C6H8N2O2S and molecular weight 172.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-azaniumyl-3-(1,3-thiazol-2-yl)propanoate
Also Known As: 1H-benzimidazol-5-ylmethanol, (2S)-2-azaniumyl-3-(1,3-thiazol-2-yl)propanoate
| Molecular Formula | C6H8N2O2S |
|---|---|
| Molecular Weight | 172.03 g/mol |
| LogP | -1.954 |
| Topological Polar Surface Area | 80.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 172.03065 |
| Heavy Atoms | 11 |
| Complexity | 234.74014 |
Chemical Identifiers
| CAS Number | 1596-65-2 |
|---|---|
| SMILES | C1=CSC(=N1)C[C@@H](C(=O)[O-])[NH3+] |
Product Overview
(2S)-2-azaniumyl-3-(1,3-thiazol-2-yl)propanoate (CAS 1596-65-2), with molecular formula C6H8N2O2S and molecular weight 172.03 g/mol. IUPAC: (2S)-2-azaniumyl-3-(1,3-thiazol-2-yl)propanoate.
Chemical Property Profile of (2S)-2-azaniumyl-3-(1,3-thiazol-2-yl)propanoate
Property Insights of (2S)-2-azaniumyl-3-(1,3-thiazol-2-yl)propanoate
The XLogP value of -1.954 indicates that (2S)-2-azaniumyl-3-(1,3-thiazol-2-yl)propanoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 80.66 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-azaniumyl-3-(1,3-thiazol-2-yl)propanoate. Following Lipinski's Rule of Five, (2S)-2-azaniumyl-3-(1,3-thiazol-2-yl)propanoate 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 (2S)-2-azaniumyl-3-(1,3-thiazol-2-yl)propanoate?
The CAS number of (2S)-2-azaniumyl-3-(1,3-thiazol-2-yl)propanoate is 1596-65-2.
What is the molecular formula of (2S)-2-azaniumyl-3-(1,3-thiazol-2-yl)propanoate?
The molecular formula of (2S)-2-azaniumyl-3-(1,3-thiazol-2-yl)propanoate is C6H8N2O2S.
What is the molecular weight of (2S)-2-azaniumyl-3-(1,3-thiazol-2-yl)propanoate?
The molecular weight of (2S)-2-azaniumyl-3-(1,3-thiazol-2-yl)propanoate is 172.03 g/mol.
Where can I buy (2S)-2-azaniumyl-3-(1,3-thiazol-2-yl)propanoate?
You can request a quote for (2S)-2-azaniumyl-3-(1,3-thiazol-2-yl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-azaniumyl-3-(1,3-thiazol-2-yl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-azaniumyl-3-(1,3-thiazol-2-yl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.