5-(3-phenylisoxazol-5-yl)-2'-deoxyuridine
TL;DR: 5-(3-phenylisoxazol-5-yl)-2'-deoxyuridine (CAS 133070-83-4) is a chemical compound with molecular formula C18H17N3O6 and molecular weight 371.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(3-phenyl-1,2-oxazol-5-yl)pyrimidine-2,4-dione
Also Known As: 5-(3-phenylisoxazol-5-yl)-2'-deoxyuridine, 5-[3-Phenylisoxazol-5-yl]-2 -deoxyuridine, 1-((2R,4S,5R)-4-Hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-(3-phenyl-isoxazol-5-yl)-1H-pyrimidine-2,4-dione, Uridine, 2'-deoxy-5-(3-phenyl-5-isoxazolyl)-, Uridine,2'-deoxy-5-(3-phenyl-5-isoxazolyl)- (9CI)
| Molecular Formula | C18H17N3O6 |
|---|---|
| Molecular Weight | 371.11 g/mol |
| LogP | 0.4993 |
| Topological Polar Surface Area | 130.58 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 371.11172 |
| Heavy Atoms | 27 |
| Complexity | 1054.7041 |
Chemical Identifiers
| CAS Number | 133070-83-4 |
|---|---|
| SMILES | C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)C3=CC(=NO3)C4=CC=CC=C4)CO)O |
Product Overview
5-(3-phenylisoxazol-5-yl)-2'-deoxyuridine (CAS 133070-83-4), with molecular formula C18H17N3O6 and molecular weight 371.11 g/mol. IUPAC: 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(3-phenyl-1,2-oxazol-5-yl)pyrimidine-2,4-dione.
Chemical Property Profile of 5-(3-phenylisoxazol-5-yl)-2'-deoxyuridine
Property Insights of 5-(3-phenylisoxazol-5-yl)-2'-deoxyuridine
The XLogP value of 0.4993 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(3-phenylisoxazol-5-yl)-2'-deoxyuridine. The TPSA of 130.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(3-phenylisoxazol-5-yl)-2'-deoxyuridine. Following Lipinski's Rule of Five, 5-(3-phenylisoxazol-5-yl)-2'-deoxyuridine has 3 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 5-(3-phenylisoxazol-5-yl)-2'-deoxyuridine?
The CAS number of 5-(3-phenylisoxazol-5-yl)-2'-deoxyuridine is 133070-83-4.
What is the molecular formula of 5-(3-phenylisoxazol-5-yl)-2'-deoxyuridine?
The molecular formula of 5-(3-phenylisoxazol-5-yl)-2'-deoxyuridine is C18H17N3O6.
What is the molecular weight of 5-(3-phenylisoxazol-5-yl)-2'-deoxyuridine?
The molecular weight of 5-(3-phenylisoxazol-5-yl)-2'-deoxyuridine is 371.11 g/mol.
Where can I buy 5-(3-phenylisoxazol-5-yl)-2'-deoxyuridine?
You can request a quote for 5-(3-phenylisoxazol-5-yl)-2'-deoxyuridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(3-phenylisoxazol-5-yl)-2'-deoxyuridine?
Yes, KEHONG BIO provides custom synthesis services for 5-(3-phenylisoxazol-5-yl)-2'-deoxyuridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.