6-Aza-2'-deoxycytidine
TL;DR: 6-Aza-2'-deoxycytidine (CAS 50-92-0) is a chemical compound with molecular formula C8H12N4O4 and molecular weight 228.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-2-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2,4-triazin-3-one
Also Known As: 6-aza-2'-deoxycytidine, 2 -Deoxy-6-azacytidine, J2.488.988B, 5-amino-2-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2,4-tri, 5-Amino-2-(2-deoxy-
| Molecular Formula | C8H12N4O4 |
|---|---|
| Molecular Weight | 228.09 g/mol |
| LogP | -2.1388 |
| Topological Polar Surface Area | 123.49 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.08586 |
| Heavy Atoms | 16 |
| Complexity | 434.29166 |
Chemical Identifiers
| CAS Number | 50-92-0 |
|---|---|
| SMILES | C1[C@@H]([C@H](O[C@H]1N2C(=O)N=C(C=N2)N)CO)O |
Product Overview
6-Aza-2'-deoxycytidine (CAS 50-92-0), with molecular formula C8H12N4O4 and molecular weight 228.09 g/mol. IUPAC: 5-amino-2-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2,4-triazin-3-one.
Chemical Property Profile of 6-Aza-2'-deoxycytidine
Property Insights of 6-Aza-2'-deoxycytidine
The XLogP value of -2.1388 indicates that 6-Aza-2'-deoxycytidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 123.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Aza-2'-deoxycytidine. Following Lipinski's Rule of Five, 6-Aza-2'-deoxycytidine 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 6-Aza-2'-deoxycytidine?
The CAS number of 6-Aza-2'-deoxycytidine is 50-92-0.
What is the molecular formula of 6-Aza-2'-deoxycytidine?
The molecular formula of 6-Aza-2'-deoxycytidine is C8H12N4O4.
What is the molecular weight of 6-Aza-2'-deoxycytidine?
The molecular weight of 6-Aza-2'-deoxycytidine is 228.09 g/mol.
Where can I buy 6-Aza-2'-deoxycytidine?
You can request a quote for 6-Aza-2'-deoxycytidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Aza-2'-deoxycytidine?
Yes, KEHONG BIO provides custom synthesis services for 6-Aza-2'-deoxycytidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.