Einecs 255-399-6
TL;DR: Einecs 255-399-6 (CAS 41489-07-0) is a chemical compound with molecular formula C27H53N3O5 and molecular weight 499.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hexadecyl (2S)-2,6-diaminohexanoate;5-oxopyrrolidine-2-carboxylic acid
Also Known As: EINECS 255-399-6, 5-Oxo-DL-proline, compound with hexadecyl L-lysinate (1:1), hexadecyl (2S)-2,6-diaminohexanoate; 5-oxopyrrolidine-2-carboxylic acid, 5-Hydroxy-3,4-dihydro-2H-pyrrole-2-carboxylic acid--hexadecyl L-lysinate (1/1), 5-Hydroxy-3,4-dihydro-2H-pyrrole-2-carboxylic acid--hexadecyl lysinate (1/1)
| Molecular Formula | C27H53N3O5 |
|---|---|
| Molecular Weight | 499.40 g/mol |
| LogP | 4.8168 |
| Topological Polar Surface Area | 144.74 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 21 |
| Exact Mass | 499.39853 |
| Heavy Atoms | 35 |
| Complexity | 544.9098 |
Chemical Identifiers
| CAS Number | 41489-07-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCOC(=O)[C@H](CCCCN)N.C1CC(=O)NC1C(=O)O |
Product Overview
Einecs 255-399-6 (CAS 41489-07-0), with molecular formula C27H53N3O5 and molecular weight 499.40 g/mol. IUPAC: hexadecyl (2S)-2,6-diaminohexanoate;5-oxopyrrolidine-2-carboxylic acid.
Chemical Property Profile of Einecs 255-399-6
Property Insights of Einecs 255-399-6
The XLogP value of 4.8168 indicates that Einecs 255-399-6 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 144.74 Ų indicates high polarity, suggesting Einecs 255-399-6 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Einecs 255-399-6 has 4 hydrogen bond donor(s) and 6 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 Einecs 255-399-6?
The CAS number of Einecs 255-399-6 is 41489-07-0.
What is the molecular formula of Einecs 255-399-6?
The molecular formula of Einecs 255-399-6 is C27H53N3O5.
What is the molecular weight of Einecs 255-399-6?
The molecular weight of Einecs 255-399-6 is 499.40 g/mol.
Where can I buy Einecs 255-399-6?
You can request a quote for Einecs 255-399-6 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 255-399-6?
Yes, KEHONG BIO provides custom synthesis services for Einecs 255-399-6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.