gamma-Glutamyl-beta-aminopropiononitrile
TL;DR: gamma-Glutamyl-beta-aminopropiononitrile (CAS 539-95-7) is a chemical compound with molecular formula C8H13N3O3 and molecular weight 199.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-5-(2-cyanoethylamino)-5-oxopentanoic acid
Also Known As: gamma-Glutamyl-beta-aminopropiononitrile, N-(2-Cyanoethyl)-L-glutamine, gamma-Glutamyl-3-aminopropiononitrile, 3-(L-gamma-Glutamylamino)propanenitrile, (2S)-2-amino-5-(2-cyanoethylamino)-5-oxopentanoic acid
| Molecular Formula | C8H13N3O3 |
|---|---|
| Molecular Weight | 199.10 g/mol |
| LogP | -4.2 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 199.09569 |
| Heavy Atoms | 14 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 539-95-7 |
|---|---|
| SMILES | C(CNC(=O)CC[C@@H](C(=O)O)N)C#N |
| InChIKey | VQPVVWAFTIFKDD-LURJTMIESA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
gamma-Glutamyl-beta-aminopropiononitrile (CAS 539-95-7), with molecular formula C8H13N3O3 and molecular weight 199.10 g/mol. IUPAC: (2S)-2-amino-5-(2-cyanoethylamino)-5-oxopentanoic acid.
Chemical Property Profile of gamma-Glutamyl-beta-aminopropiononitrile
Property Insights of gamma-Glutamyl-beta-aminopropiononitrile
The XLogP value of -4.2 indicates that gamma-Glutamyl-beta-aminopropiononitrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for gamma-Glutamyl-beta-aminopropiononitrile. Following Lipinski's Rule of Five, gamma-Glutamyl-beta-aminopropiononitrile has 3 hydrogen bond donor(s) and 5 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 gamma-Glutamyl-beta-aminopropiononitrile?
The CAS number of gamma-Glutamyl-beta-aminopropiononitrile is 539-95-7.
What is the molecular formula of gamma-Glutamyl-beta-aminopropiononitrile?
The molecular formula of gamma-Glutamyl-beta-aminopropiononitrile is C8H13N3O3.
What is the molecular weight of gamma-Glutamyl-beta-aminopropiononitrile?
The molecular weight of gamma-Glutamyl-beta-aminopropiononitrile is 199.10 g/mol.
Where can I buy gamma-Glutamyl-beta-aminopropiononitrile?
You can request a quote for gamma-Glutamyl-beta-aminopropiononitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for gamma-Glutamyl-beta-aminopropiononitrile?
Yes, KEHONG BIO provides custom synthesis services for gamma-Glutamyl-beta-aminopropiononitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.