Valopicitabine
TL;DR: Valopicitabine (CAS 640281-90-9) is a chemical compound with molecular formula C15H24N4O6 and molecular weight 356.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3R,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-4-hydroxy-2-(hydroxymethyl)-4-methyloxolan-3-yl] (2S)-2-amino-3-methylbutanoate
Also Known As: Valopicitabine, valopicitabina, valopicitabinum, val-mCyd, Valopicitabine [INN]
| Molecular Formula | C15H24N4O6 |
|---|---|
| Molecular Weight | 356.17 g/mol |
| LogP | -1.6387 |
| Topological Polar Surface Area | 162.92 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 356.1696 |
| Heavy Atoms | 25 |
| Complexity | 688.8443 |
Chemical Identifiers
| CAS Number | 640281-90-9 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)O[C@@H]1[C@H](O[C@H]([C@]1(C)O)N2C=CC(=NC2=O)N)CO)N |
Product Overview
Valopicitabine (CAS 640281-90-9), with molecular formula C15H24N4O6 and molecular weight 356.17 g/mol. IUPAC: [(2R,3R,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-4-hydroxy-2-(hydroxymethyl)-4-methyloxolan-3-yl] (2S)-2-amino-3-methylbutanoate.
Chemical Property Profile of Valopicitabine
Property Insights of Valopicitabine
The XLogP value of -1.6387 indicates that Valopicitabine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 162.92 Ų indicates high polarity, suggesting Valopicitabine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Valopicitabine has 4 hydrogen bond donor(s) and 9 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 Valopicitabine?
The CAS number of Valopicitabine is 640281-90-9.
What is the molecular formula of Valopicitabine?
The molecular formula of Valopicitabine is C15H24N4O6.
What is the molecular weight of Valopicitabine?
The molecular weight of Valopicitabine is 356.17 g/mol.
Where can I buy Valopicitabine?
You can request a quote for Valopicitabine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Valopicitabine?
Yes, KEHONG BIO provides custom synthesis services for Valopicitabine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.