Ara-C 5'-benzoate
TL;DR: Ara-C 5'-benzoate (CAS 34270-10-5) is a chemical compound with molecular formula C16H17N3O6 and molecular weight 347.11172 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2R,3S,4S)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl benzoate
Also Known As: Ara-C 5'-benzoate, Cytarabine 5'-benzoate, 1-(5-O-Benzoylpentofuranosyl)-4-imino-1,4-dihydropyrimidin-2-ol, 4-amino-1-(5-o-benzoyl-d-arabinofuranosyl)pyrimidin-2(1h)-one, [(2R,3S,4S)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl benzoate
Technical Specifications
| Molecular Formula | C16H17N3O6 |
| Molecular Weight | 347.11172 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 135.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 347.11172 Da |
| Heavy Atoms | 25 |
| Complexity | 586.0 |
| SMILES | C1=CC=C(C=C1)C(=O)OC[C@@H]2[C@H]([C@@H](C(O2)N3C=CC(=NC3=O)N)O)O |
| InChIKey | FGSKBSJIDNIGEV-BKQLOGFTSA-N |
Chemical Property Profile of Ara-C 5'-benzoate
Property Insights of Ara-C 5'-benzoate
The XLogP value of -0.1 indicates that Ara-C 5'-benzoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ara-C 5'-benzoate. Following Lipinski's Rule of Five, Ara-C 5'-benzoate has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ara-C 5'-benzoate?
The CAS number of Ara-C 5'-benzoate is 34270-10-5.
What is the molecular formula of Ara-C 5'-benzoate?
The molecular formula of Ara-C 5'-benzoate is C16H17N3O6.
What is the molecular weight of Ara-C 5'-benzoate?
The molecular weight of Ara-C 5'-benzoate is 347.11172 g/mol.
Where can I buy Ara-C 5'-benzoate?
You can request a quote for Ara-C 5'-benzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ara-C 5'-benzoate?
Yes, CoreyChem provides custom synthesis services for Ara-C 5'-benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.