Refractin
TL;DR: Refractin (CAS 2517-52-4) is a chemical compound with molecular formula C23H28N2O4 and molecular weight 396.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-formyl-4-methoxy-2,12-diazahexacyclo[14.2.2.19,12.01,9.03,8.016,21]henicosa-3(8),4,6-triene-18-carboxylate
Also Known As: Vellosine, Refractine, Refractin, 21-Isorefractine, NCIOpen2_008824
| Molecular Formula | C23H28N2O4 |
|---|---|
| Molecular Weight | 396.20 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 59.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 396.2049 |
| Heavy Atoms | 29 |
| Complexity | 744.0 |
Chemical Identifiers
| CAS Number | 2517-52-4 |
|---|---|
| SMILES | COC1=CC=CC2=C1N(C34C25CCN6C5C(CCC6)(CC3)CC4C(=O)OC)C=O |
| InChIKey | NJLKGEGVAFDBDJ-UHFFFAOYSA-N |
Product Overview
Refractin (CAS 2517-52-4), with molecular formula C23H28N2O4 and molecular weight 396.20 g/mol. IUPAC: methyl 2-formyl-4-methoxy-2,12-diazahexacyclo[14.2.2.19,12.01,9.03,8.016,21]henicosa-3(8),4,6-triene-18-carboxylate.
Chemical Property Profile of Refractin
Property Insights of Refractin
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Refractin. With a topological polar surface area (TPSA) of 59.1 Ų, Refractin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Refractin has 0 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 Refractin?
The CAS number of Refractin is 2517-52-4.
What is the molecular formula of Refractin?
The molecular formula of Refractin is C23H28N2O4.
What is the molecular weight of Refractin?
The molecular weight of Refractin is 396.20 g/mol.
Where can I buy Refractin?
You can request a quote for Refractin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Refractin?
Yes, KEHONG BIO provides custom synthesis services for Refractin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.