6'-F-carbocyclicddA
TL;DR: 6'-F-carbocyclicddA (CAS 129746-12-9) is a chemical compound with molecular formula C11H14FN5O and molecular weight 251.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,2R,3S)-3-(6-aminopurin-9-yl)-2-fluorocyclopentyl]methanol
Also Known As: 6'-F-carbocyclicddA, 2',3'-Dideoxy-6'-beta-fluoro-carbocyclicadenosine, Cyclopentanemethanol, 3-(6-amino-9H-purin-9-yl)-2-fluoro-, (1alpha,2alpha,3alpha)-, 2',3'-Dideoxy-6'-.beta.-fluoro-carbocyclicadenosine, [(1S,2R,3S)-3-(6-aminopurin-9-yl)-2-fluoro-cyclopentyl]methanol
| Molecular Formula | C11H14FN5O |
|---|---|
| Molecular Weight | 251.12 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 89.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.11824 |
| Heavy Atoms | 18 |
| Complexity | 307.0 |
Chemical Identifiers
| CAS Number | 129746-12-9 |
|---|---|
| SMILES | C1C[C@@H]([C@@H]([C@@H]1CO)F)N2C=NC3=C(N=CN=C32)N |
| InChIKey | XVEWVASUVJQSBT-BIIVOSGPSA-N |
Product Overview
6'-F-carbocyclicddA (CAS 129746-12-9), with molecular formula C11H14FN5O and molecular weight 251.12 g/mol. IUPAC: [(1S,2R,3S)-3-(6-aminopurin-9-yl)-2-fluorocyclopentyl]methanol.
Chemical Property Profile of 6'-F-carbocyclicddA
Property Insights of 6'-F-carbocyclicddA
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6'-F-carbocyclicddA. The TPSA of 89.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 6'-F-carbocyclicddA. Following Lipinski's Rule of Five, 6'-F-carbocyclicddA has 2 hydrogen bond donor(s) and 6 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'-F-carbocyclicddA?
The CAS number of 6'-F-carbocyclicddA is 129746-12-9.
What is the molecular formula of 6'-F-carbocyclicddA?
The molecular formula of 6'-F-carbocyclicddA is C11H14FN5O.
What is the molecular weight of 6'-F-carbocyclicddA?
The molecular weight of 6'-F-carbocyclicddA is 251.12 g/mol.
Where can I buy 6'-F-carbocyclicddA?
You can request a quote for 6'-F-carbocyclicddA directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6'-F-carbocyclicddA?
Yes, KEHONG BIO provides custom synthesis services for 6'-F-carbocyclicddA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.