Pyrraline
TL;DR: Pyrraline (CAS 74509-14-1) is a chemical compound with molecular formula C12H18N2O4 and molecular weight 254.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-6-[2-formyl-5-(hydroxymethyl)pyrrol-1-yl]hexanoic acid
Also Known As: Pyrraline, L-lysyl pyrraline, 2-Fhmpn, pyrraline-lysine, epsilon-pyrraline
| Molecular Formula | C12H18N2O4 |
|---|---|
| Molecular Weight | 254.13 g/mol |
| LogP | -3.0 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 254.12666 |
| Heavy Atoms | 18 |
| Complexity | 285.0 |
Chemical Identifiers
| CAS Number | 74509-14-1 |
|---|---|
| SMILES | C1=C(N(C(=C1)C=O)CCCC[C@@H](C(=O)O)N)CO |
| InChIKey | VTYFITADLSVOAS-NSHDSACASA-N |
Product Overview
Pyrraline (CAS 74509-14-1), with molecular formula C12H18N2O4 and molecular weight 254.13 g/mol. IUPAC: (2S)-2-amino-6-[2-formyl-5-(hydroxymethyl)pyrrol-1-yl]hexanoic acid.
Chemical Property Profile of Pyrraline
Property Insights of Pyrraline
The XLogP value of -3.0 indicates that Pyrraline is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrraline. Following Lipinski's Rule of Five, Pyrraline 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 Pyrraline?
The CAS number of Pyrraline is 74509-14-1.
What is the molecular formula of Pyrraline?
The molecular formula of Pyrraline is C12H18N2O4.
What is the molecular weight of Pyrraline?
The molecular weight of Pyrraline is 254.13 g/mol.
Where can I buy Pyrraline?
You can request a quote for Pyrraline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrraline?
Yes, KEHONG BIO provides custom synthesis services for Pyrraline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.