adenosine, 2-amino-2'-deoxy-N-2-propyl-4'-thio-
TL;DR: adenosine, 2-amino-2'-deoxy-N-2-propyl-4'-thio- (CAS 160526-40-9) is a chemical compound with molecular formula C13H20N6O2S and molecular weight 324.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3S,5R)-5-[2-amino-6-(propan-2-ylamino)purin-9-yl]-2-(hydroxymethyl)thiolan-3-ol
Also Known As: adenosine, 2-amino-2'-deoxy-N-2-propyl-4'-thio-, adenosine, 2-amino-2'-deoxy-N-(1-methylethyl)-4'-thio-, (2R,3S,5R)-5-[2-amino-6-(propan-2-ylamino)purin-9-yl]-2-(hydroxymethyl)thiolan-3-ol, 2-Amino-9-(2-deoxy-4-thio-beta-D-erythro-pentofuranosyl)-6-(isopropylamino)-9H-purine, N -Isopropyl-9-(2-deoxy-4-thio-beta-D-erythro-pentofuranosyl)-9H-purine-2,6-diamine
| Molecular Formula | C13H20N6O2S |
|---|---|
| Molecular Weight | 324.14 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 147.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 324.13684 |
| Heavy Atoms | 22 |
| Complexity | 390.0 |
Chemical Identifiers
| CAS Number | 160526-40-9 |
|---|---|
| SMILES | CC(C)NC1=C2C(=NC(=N1)N)N(C=N2)[C@H]3C[C@@H]([C@H](S3)CO)O |
| InChIKey | ZGFIJNDJAMIYRB-DJLDLDEBSA-N |
Product Overview
adenosine, 2-amino-2'-deoxy-N-2-propyl-4'-thio- (CAS 160526-40-9), with molecular formula C13H20N6O2S and molecular weight 324.14 g/mol. IUPAC: (2R,3S,5R)-5-[2-amino-6-(propan-2-ylamino)purin-9-yl]-2-(hydroxymethyl)thiolan-3-ol.
Chemical Property Profile of adenosine, 2-amino-2'-deoxy-N-2-propyl-4'-thio-
Property Insights of adenosine, 2-amino-2'-deoxy-N-2-propyl-4'-thio-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for adenosine, 2-amino-2'-deoxy-N-2-propyl-4'-thio-. The TPSA of 147.0 Ų indicates high polarity, suggesting adenosine, 2-amino-2'-deoxy-N-2-propyl-4'-thio- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, adenosine, 2-amino-2'-deoxy-N-2-propyl-4'-thio- has 4 hydrogen bond donor(s) and 8 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 adenosine, 2-amino-2'-deoxy-N-2-propyl-4'-thio-?
The CAS number of adenosine, 2-amino-2'-deoxy-N-2-propyl-4'-thio- is 160526-40-9.
What is the molecular formula of adenosine, 2-amino-2'-deoxy-N-2-propyl-4'-thio-?
The molecular formula of adenosine, 2-amino-2'-deoxy-N-2-propyl-4'-thio- is C13H20N6O2S.
What is the molecular weight of adenosine, 2-amino-2'-deoxy-N-2-propyl-4'-thio-?
The molecular weight of adenosine, 2-amino-2'-deoxy-N-2-propyl-4'-thio- is 324.14 g/mol.
Where can I buy adenosine, 2-amino-2'-deoxy-N-2-propyl-4'-thio-?
You can request a quote for adenosine, 2-amino-2'-deoxy-N-2-propyl-4'-thio- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for adenosine, 2-amino-2'-deoxy-N-2-propyl-4'-thio-?
Yes, KEHONG BIO provides custom synthesis services for adenosine, 2-amino-2'-deoxy-N-2-propyl-4'-thio- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.