Nucleocidin, 2',3'-i-Pr analog
TL;DR: Nucleocidin, 2',3'-i-Pr analog (CAS 30685-66-6) is a chemical compound with molecular formula C13H16IN5O3 and molecular weight 417.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-[(3aR,4R,6S,6aS)-6-(iodomethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]purin-6-amine
Also Known As: Nucleocidin, 2',3'-i-Pr analog, 5'-DEOXY-2',3'-O-ISOPROPYLIDENE-5'-IODO-ADENOSINE, 5'-Deoxy-5'-iodo-2',3'-O-isopropylideneadenosine, 9-[(3aR,4R,6S,6aS)-6-(iodomethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]purin-6-amine
| Molecular Formula | C13H16IN5O3 |
|---|---|
| Molecular Weight | 417.03 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 97.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 417.0298 |
| Heavy Atoms | 22 |
| Complexity | 442.0 |
Chemical Identifiers
| CAS Number | 30685-66-6 |
|---|---|
| SMILES | CC1(O[C@@H]2[C@H](O[C@H]([C@@H]2O1)N3C=NC4=C(N=CN=C43)N)CI)C |
| InChIKey | DPEHZPBZYGVHMH-WOUKDFQISA-N |
Product Overview
Nucleocidin, 2',3'-i-Pr analog (CAS 30685-66-6), with molecular formula C13H16IN5O3 and molecular weight 417.03 g/mol. IUPAC: 9-[(3aR,4R,6S,6aS)-6-(iodomethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]purin-6-amine.
Chemical Property Profile of Nucleocidin, 2',3'-i-Pr analog
Property Insights of Nucleocidin, 2',3'-i-Pr analog
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nucleocidin, 2',3'-i-Pr analog. The TPSA of 97.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Nucleocidin, 2',3'-i-Pr analog. Following Lipinski's Rule of Five, Nucleocidin, 2',3'-i-Pr analog has 1 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 Nucleocidin, 2',3'-i-Pr analog?
The CAS number of Nucleocidin, 2',3'-i-Pr analog is 30685-66-6.
What is the molecular formula of Nucleocidin, 2',3'-i-Pr analog?
The molecular formula of Nucleocidin, 2',3'-i-Pr analog is C13H16IN5O3.
What is the molecular weight of Nucleocidin, 2',3'-i-Pr analog?
The molecular weight of Nucleocidin, 2',3'-i-Pr analog is 417.03 g/mol.
Where can I buy Nucleocidin, 2',3'-i-Pr analog?
You can request a quote for Nucleocidin, 2',3'-i-Pr analog directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nucleocidin, 2',3'-i-Pr analog?
Yes, KEHONG BIO provides custom synthesis services for Nucleocidin, 2',3'-i-Pr analog and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.