1-(3'-Iodo-3'-deoxyarabinofuranosyl)uracil
TL;DR: 1-(3'-Iodo-3'-deoxyarabinofuranosyl)uracil (CAS 22131-66-4) is a chemical compound with molecular formula C9H11IN2O5 and molecular weight 353.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2R,3R,4S,5R)-3-hydroxy-5-(hydroxymethyl)-4-iodooxolan-2-yl]pyrimidine-2,4-dione
Also Known As: 3-I-Ara-U, 1-(3'-Iodo-3'-deoxyarabinofuranosyl)uracil, 1-(3/'-iodo-3/'-deoxyarabinofuranosyl)uracil, 1-[(2R,3R,4S,5R)-3-hydroxy-5-(hydroxymethyl)-4-iodooxolan-2-yl]pyrimidine-2,4-dione, 2,4(1h,3h)-pyrimidinedione, 1-(3-deoxy-3-iodo-
| Molecular Formula | C9H11IN2O5 |
|---|---|
| Molecular Weight | 353.97 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 99.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 353.97128 |
| Heavy Atoms | 17 |
| Complexity | 374.0 |
Chemical Identifiers
| CAS Number | 22131-66-4 |
|---|---|
| SMILES | C1=CN(C(=O)NC1=O)[C@H]2[C@H]([C@@H]([C@H](O2)CO)I)O |
| InChIKey | ZPBRIWRUKVZCRW-CCXZUQQUSA-N |
Product Overview
1-(3'-Iodo-3'-deoxyarabinofuranosyl)uracil (CAS 22131-66-4), with molecular formula C9H11IN2O5 and molecular weight 353.97 g/mol. IUPAC: 1-[(2R,3R,4S,5R)-3-hydroxy-5-(hydroxymethyl)-4-iodooxolan-2-yl]pyrimidine-2,4-dione.
Chemical Property Profile of 1-(3'-Iodo-3'-deoxyarabinofuranosyl)uracil
Property Insights of 1-(3'-Iodo-3'-deoxyarabinofuranosyl)uracil
The XLogP value of -0.9 indicates that 1-(3'-Iodo-3'-deoxyarabinofuranosyl)uracil is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3'-Iodo-3'-deoxyarabinofuranosyl)uracil. Following Lipinski's Rule of Five, 1-(3'-Iodo-3'-deoxyarabinofuranosyl)uracil has 3 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 1-(3'-Iodo-3'-deoxyarabinofuranosyl)uracil?
The CAS number of 1-(3'-Iodo-3'-deoxyarabinofuranosyl)uracil is 22131-66-4.
What is the molecular formula of 1-(3'-Iodo-3'-deoxyarabinofuranosyl)uracil?
The molecular formula of 1-(3'-Iodo-3'-deoxyarabinofuranosyl)uracil is C9H11IN2O5.
What is the molecular weight of 1-(3'-Iodo-3'-deoxyarabinofuranosyl)uracil?
The molecular weight of 1-(3'-Iodo-3'-deoxyarabinofuranosyl)uracil is 353.97 g/mol.
Where can I buy 1-(3'-Iodo-3'-deoxyarabinofuranosyl)uracil?
You can request a quote for 1-(3'-Iodo-3'-deoxyarabinofuranosyl)uracil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3'-Iodo-3'-deoxyarabinofuranosyl)uracil?
Yes, KEHONG BIO provides custom synthesis services for 1-(3'-Iodo-3'-deoxyarabinofuranosyl)uracil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.