cytarabine
TL;DR: cytarabine (CAS 16110-07-9) is a chemical compound with molecular formula C9H13N3O5 and molecular weight 243.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-1-[(2R,3S,4S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
Also Known As: cytarabine, .alpha.-L-Xylo-C, Azacitidine Impurity 57, 4-amino-1--L-xylofuranosyl-2(1H)-pyrimidinone, Cytarabine Impurity 48; Azacitidine Impurity 23
| Molecular Formula | C9H13N3O5 |
|---|---|
| Molecular Weight | 243.09 g/mol |
| LogP | -2.563 |
| Topological Polar Surface Area | 130.83 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 243.08553 |
| Heavy Atoms | 17 |
| Complexity | 462.1897 |
Chemical Identifiers
| CAS Number | 16110-07-9 |
|---|---|
| SMILES | C1=CN(C(=O)N=C1N)[C@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O |
Product Overview
cytarabine (CAS 16110-07-9), with molecular formula C9H13N3O5 and molecular weight 243.09 g/mol. IUPAC: 4-amino-1-[(2R,3S,4S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one.
Chemical Property Profile of cytarabine
Property Insights of cytarabine
The XLogP value of -2.563 indicates that cytarabine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 130.83 Ų falls within the moderate polarity range, balancing permeability and solubility for cytarabine. Following Lipinski's Rule of Five, cytarabine has 4 hydrogen bond donor(s) and 7 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 cytarabine?
The CAS number of cytarabine is 16110-07-9.
What is the molecular formula of cytarabine?
The molecular formula of cytarabine is C9H13N3O5.
What is the molecular weight of cytarabine?
The molecular weight of cytarabine is 243.09 g/mol.
Where can I buy cytarabine?
You can request a quote for cytarabine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cytarabine?
Yes, KEHONG BIO provides custom synthesis services for cytarabine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.