2'-Deoxytetrahydrouridine
TL;DR: 2'-Deoxytetrahydrouridine (CAS 3699-28-3) is a chemical compound with molecular formula C9H16N2O5 and molecular weight 232.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,3-diazinan-2-one
Also Known As: Tetraphthen, THDU, Tetrahydro-2'-deoxyuridine, 2'-Deoxytetrahydrouridine, DISCONTINUED
| Molecular Formula | C9H16N2O5 |
|---|---|
| Molecular Weight | 232.11 g/mol |
| LogP | -1.4 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 232.10593 |
| Heavy Atoms | 16 |
| Complexity | 275.0 |
Chemical Identifiers
| CAS Number | 3699-28-3 |
|---|---|
| SMILES | C1CN(C(=O)NC1O)[C@H]2C[C@@H]([C@H](O2)CO)O |
| InChIKey | RSRNLJYSWSSQMW-CZLDRYSHSA-N |
Product Overview
2'-Deoxytetrahydrouridine (CAS 3699-28-3), with molecular formula C9H16N2O5 and molecular weight 232.11 g/mol. IUPAC: 4-hydroxy-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,3-diazinan-2-one.
Chemical Property Profile of 2'-Deoxytetrahydrouridine
Property Insights of 2'-Deoxytetrahydrouridine
The XLogP value of -1.4 indicates that 2'-Deoxytetrahydrouridine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2'-Deoxytetrahydrouridine. Following Lipinski's Rule of Five, 2'-Deoxytetrahydrouridine has 4 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 2'-Deoxytetrahydrouridine?
The CAS number of 2'-Deoxytetrahydrouridine is 3699-28-3.
What is the molecular formula of 2'-Deoxytetrahydrouridine?
The molecular formula of 2'-Deoxytetrahydrouridine is C9H16N2O5.
What is the molecular weight of 2'-Deoxytetrahydrouridine?
The molecular weight of 2'-Deoxytetrahydrouridine is 232.11 g/mol.
Where can I buy 2'-Deoxytetrahydrouridine?
You can request a quote for 2'-Deoxytetrahydrouridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2'-Deoxytetrahydrouridine?
Yes, KEHONG BIO provides custom synthesis services for 2'-Deoxytetrahydrouridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.