Nucleocidin, 2',3'-i-Pr analog
TL;DR: Nucleocidin, 2',3'-i-Pr analog (CAS 68200-72-6) is a chemical compound with molecular formula C20H20IN5O4 and molecular weight 521.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[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-yl]benzamide
Also Known As: Nucleocidin, 2',3'-i-Pr analog, N^6-Benzoyl-5'-deoxy-5'-iodo-2',3'-O-isopropylideneadenosine, N-[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-yl]benzamide, N-Benzoyl-5'-deoxy-5'-iodo-2',3'-O-(1-methylethylidene)-adenosine, N-Benzoyl-5'-deoxy-5'-iodo-2',3'-O-(1-methylethylidene)-adenosine, 95+%
| Molecular Formula | C20H20IN5O4 |
|---|---|
| Molecular Weight | 521.06 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 521.056 |
| Heavy Atoms | 30 |
| Complexity | 649.0 |
Chemical Identifiers
| CAS Number | 68200-72-6 |
|---|---|
| SMILES | CC1(O[C@@H]2[C@H](O[C@H]([C@@H]2O1)N3C=NC4=C(N=CN=C43)NC(=O)C5=CC=CC=C5)CI)C |
| InChIKey | SCFMQQDZPFBOLD-QEPJRFBGSA-N |
Product Overview
Nucleocidin, 2',3'-i-Pr analog (CAS 68200-72-6), with molecular formula C20H20IN5O4 and molecular weight 521.06 g/mol. IUPAC: N-[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-yl]benzamide.
Chemical Property Profile of Nucleocidin, 2',3'-i-Pr analog
Property Insights of Nucleocidin, 2',3'-i-Pr analog
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nucleocidin, 2',3'-i-Pr analog. The TPSA of 100.0 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), which may warrant consideration for formulation optimization.
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 68200-72-6.
What is the molecular formula of Nucleocidin, 2',3'-i-Pr analog?
The molecular formula of Nucleocidin, 2',3'-i-Pr analog is C20H20IN5O4.
What is the molecular weight of Nucleocidin, 2',3'-i-Pr analog?
The molecular weight of Nucleocidin, 2',3'-i-Pr analog is 521.06 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.