9-Deaza-ddA
TL;DR: 9-Deaza-ddA (CAS 185905-46-8) is a chemical compound with molecular formula C11H14N4O2 and molecular weight 234.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,5R)-5-(4-amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl)oxolan-2-yl]methanol
Also Known As: 9-Deaza-ddA, 2',3'-Dideoxy-9-deazaadenosine, 2-Furanmethanol, 5-(4-amino-5H-pyrrolo(3,2-d)pyrimidin-7-yl)tetrahydro-, (2S-cis)-, [(2S,5R)-5-(4-amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl)oxolan-2-yl]methanol, [(2S,5R)-5-(4-amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl)tetrahydrofuran-2-yl]methanol
| Molecular Formula | C11H14N4O2 |
|---|---|
| Molecular Weight | 234.11 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 97.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.11168 |
| Heavy Atoms | 17 |
| Complexity | 278.0 |
Chemical Identifiers
| CAS Number | 185905-46-8 |
|---|---|
| SMILES | C1C[C@@H](O[C@@H]1CO)C2=CNC3=C2N=CN=C3N |
| InChIKey | DRNBCFGKTUTNRZ-POYBYMJQSA-N |
Product Overview
9-Deaza-ddA (CAS 185905-46-8), with molecular formula C11H14N4O2 and molecular weight 234.11 g/mol. IUPAC: [(2S,5R)-5-(4-amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl)oxolan-2-yl]methanol.
Chemical Property Profile of 9-Deaza-ddA
Property Insights of 9-Deaza-ddA
The XLogP value of -0.4 indicates that 9-Deaza-ddA is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 97.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-Deaza-ddA. Following Lipinski's Rule of Five, 9-Deaza-ddA 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 9-Deaza-ddA?
The CAS number of 9-Deaza-ddA is 185905-46-8.
What is the molecular formula of 9-Deaza-ddA?
The molecular formula of 9-Deaza-ddA is C11H14N4O2.
What is the molecular weight of 9-Deaza-ddA?
The molecular weight of 9-Deaza-ddA is 234.11 g/mol.
Where can I buy 9-Deaza-ddA?
You can request a quote for 9-Deaza-ddA directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Deaza-ddA?
Yes, KEHONG BIO provides custom synthesis services for 9-Deaza-ddA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.