Epoxycreatine
TL;DR: Epoxycreatine (CAS 46193-76-4) is a chemical compound with molecular formula C6H11N3O3 and molecular weight 173.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[carbamimidoyl(oxiran-2-ylmethyl)amino]acetic acid
Also Known As: Epoxycreatine, N-(2,3-Epoxypropyl)-N-amidinoglycine, n-carbamimidoyl-n-(oxiran-2-ylmethyl)glycine, Glycine, N-(aminoiminomethyl)-N-(oxiranylmethyl)-, N-Carbamimidoyl-N-[(oxiran-2-yl)methyl]glycine
| Molecular Formula | C6H11N3O3 |
|---|---|
| Molecular Weight | 173.08 g/mol |
| LogP | -1.5 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 173.08005 |
| Heavy Atoms | 12 |
| Complexity | 206.0 |
Chemical Identifiers
| CAS Number | 46193-76-4 |
|---|---|
| SMILES | C1C(O1)CN(CC(=O)O)C(=N)N |
| InChIKey | GEGOVQUAXGTHFG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Epoxycreatine (CAS 46193-76-4), with molecular formula C6H11N3O3 and molecular weight 173.08 g/mol. IUPAC: 2-[carbamimidoyl(oxiran-2-ylmethyl)amino]acetic acid.
Chemical Property Profile of Epoxycreatine
Property Insights of Epoxycreatine
The XLogP value of -1.5 indicates that Epoxycreatine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Epoxycreatine. Following Lipinski's Rule of Five, Epoxycreatine 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 Epoxycreatine?
The CAS number of Epoxycreatine is 46193-76-4.
What is the molecular formula of Epoxycreatine?
The molecular formula of Epoxycreatine is C6H11N3O3.
What is the molecular weight of Epoxycreatine?
The molecular weight of Epoxycreatine is 173.08 g/mol.
Where can I buy Epoxycreatine?
You can request a quote for Epoxycreatine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Epoxycreatine?
Yes, KEHONG BIO provides custom synthesis services for Epoxycreatine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.