3'-Isocyano-2',3'-dideoxyuridine
TL;DR: 3'-Isocyano-2',3'-dideoxyuridine (CAS 124288-72-8) is a chemical compound with molecular formula C10H11N3O4 and molecular weight 237.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2R,4S,5S)-5-(hydroxymethyl)-4-isocyanooxolan-2-yl]pyrimidine-2,4-dione
Also Known As: 3'-isocyano-ddU, 3'-isocyano-ddUrd, 3'-Isocyano-2',3'-dideoxyuridine, 2',3'-dideoxy-3'-isocyanouridine, 3/'-Isocyano-2/',3/'-dideoxyuridine
| Molecular Formula | C10H11N3O4 |
|---|---|
| Molecular Weight | 237.07 g/mol |
| LogP | -1.5 |
| Topological Polar Surface Area | 83.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.07495 |
| Heavy Atoms | 17 |
| Complexity | 425.0 |
Chemical Identifiers
| CAS Number | 124288-72-8 |
|---|---|
| SMILES | [C-]#[N+][C@H]1C[C@@H](O[C@@H]1CO)N2C=CC(=O)NC2=O |
| InChIKey | KEPYLRFTUFPYBU-LKEWCRSYSA-N |
Product Overview
3'-Isocyano-2',3'-dideoxyuridine (CAS 124288-72-8), with molecular formula C10H11N3O4 and molecular weight 237.07 g/mol. IUPAC: 1-[(2R,4S,5S)-5-(hydroxymethyl)-4-isocyanooxolan-2-yl]pyrimidine-2,4-dione.
Chemical Property Profile of 3'-Isocyano-2',3'-dideoxyuridine
Property Insights of 3'-Isocyano-2',3'-dideoxyuridine
The XLogP value of -1.5 indicates that 3'-Isocyano-2',3'-dideoxyuridine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3'-Isocyano-2',3'-dideoxyuridine. Following Lipinski's Rule of Five, 3'-Isocyano-2',3'-dideoxyuridine has 2 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 3'-Isocyano-2',3'-dideoxyuridine?
The CAS number of 3'-Isocyano-2',3'-dideoxyuridine is 124288-72-8.
What is the molecular formula of 3'-Isocyano-2',3'-dideoxyuridine?
The molecular formula of 3'-Isocyano-2',3'-dideoxyuridine is C10H11N3O4.
What is the molecular weight of 3'-Isocyano-2',3'-dideoxyuridine?
The molecular weight of 3'-Isocyano-2',3'-dideoxyuridine is 237.07 g/mol.
Where can I buy 3'-Isocyano-2',3'-dideoxyuridine?
You can request a quote for 3'-Isocyano-2',3'-dideoxyuridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3'-Isocyano-2',3'-dideoxyuridine?
Yes, KEHONG BIO provides custom synthesis services for 3'-Isocyano-2',3'-dideoxyuridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.