4-氨基-2-巯基丁酸
TL;DR: 4-氨基-2-巯基丁酸 (CAS 997-27-3) is a chemical compound with molecular formula C4H9NO2S and molecular weight 135.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-氨基-2-巯基丁酸
4-amino-2-sulfanylbutanoic acid
Also Known As: alpha-SH-GABA, 4-Amino-2-mercaptobutyric acid, 4-amino-2-sulfanylbutanoic acid, Butanoic acid, 4-amino-2-mercapto-, alpha-Mercapto-gamma-aminobutyric acid
| Molecular Formula | C4H9NO2S |
|---|---|
| Molecular Weight | 135.04 g/mol |
| LogP | -2.7 |
| Topological Polar Surface Area | 64.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 135.0354 |
| Heavy Atoms | 8 |
| Complexity | 86.0 |
Chemical Identifiers
| CAS Number | 997-27-3 |
|---|---|
| SMILES | C(CN)C(C(=O)O)S |
| InChIKey | KFSKBSQZHMNWEO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-氨基-2-巯基丁酸 (CAS 997-27-3), with molecular formula C4H9NO2S and molecular weight 135.04 g/mol. IUPAC: 4-amino-2-sulfanylbutanoic acid.
Chemical Property Profile of 4-氨基-2-巯基丁酸
Property Insights of 4-氨基-2-巯基丁酸
The XLogP value of -2.7 indicates that 4-氨基-2-巯基丁酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 64.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-氨基-2-巯基丁酸. Following Lipinski's Rule of Five, 4-氨基-2-巯基丁酸 has 3 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 4-氨基-2-巯基丁酸?
The CAS number of 4-氨基-2-巯基丁酸 is 997-27-3.
What is the molecular formula of 4-氨基-2-巯基丁酸?
The molecular formula of 4-氨基-2-巯基丁酸 is C4H9NO2S.
What is the molecular weight of 4-氨基-2-巯基丁酸?
The molecular weight of 4-氨基-2-巯基丁酸 is 135.04 g/mol.
Where can I buy 4-氨基-2-巯基丁酸?
You can request a quote for 4-氨基-2-巯基丁酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-氨基-2-巯基丁酸?
Yes, KEHONG BIO provides custom synthesis services for 4-氨基-2-巯基丁酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.