![Aceticacid, 2-[[2-amino-9-(2-methylbutyl)-9H-purin-6-yl]thio]- structure](/static/products/916/91647-49-3.png)
Aceticacid, 2-[[2-amino-9-(2-methylbutyl)-9H-purin-6-yl]thio]-
TL;DR: Aceticacid, 2-[[2-amino-9-(2-methylbutyl)-9H-purin-6-yl]thio]- (CAS 91647-49-3) is a chemical compound with molecular formula C12H17N5O2S and molecular weight 295.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-amino-9-(2-methylbutyl)purin-6-yl]sulfanylacetic acid
Also Known As: 2-[2-amino-9-(2-methylbutyl)purin-6-yl]sulfanylacetic acid, Aceticacid, 2-[[2-amino-9-(2-methylbutyl)-9H-purin-6-yl]thio]-, 2-((2-Amino-9-(2-methylbutyl)-9H-purin-6-yl)thio)acetic acid, 1-<2>Tetrahydrofuryl-4-propylamino-pyrazolo<3,4-d>pyrimidin, {[2-Amino-9-(2-methylbutyl)-9H-purin-6-yl]sulfanyl}acetic acid
| Molecular Formula | C12H17N5O2S |
|---|---|
| Molecular Weight | 295.11 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 295.1103 |
| Heavy Atoms | 20 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 91647-49-3 |
|---|---|
| SMILES | CCC(C)CN1C=NC2=C1N=C(N=C2SCC(=O)O)N |
| InChIKey | YBYHUQLRHZLSOL-UHFFFAOYSA-N |
Product Overview
Aceticacid, 2-[[2-amino-9-(2-methylbutyl)-9H-purin-6-yl]thio]- (CAS 91647-49-3), with molecular formula C12H17N5O2S and molecular weight 295.11 g/mol. IUPAC: 2-[2-amino-9-(2-methylbutyl)purin-6-yl]sulfanylacetic acid.
Chemical Property Profile of Aceticacid, 2-[[2-amino-9-(2-methylbutyl)-9H-purin-6-yl]thio]-
Property Insights of Aceticacid, 2-[[2-amino-9-(2-methylbutyl)-9H-purin-6-yl]thio]-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Aceticacid, 2-[[2-amino-9-(2-methylbutyl)-9H-purin-6-yl]thio]-. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Aceticacid, 2-[[2-amino-9-(2-methylbutyl)-9H-purin-6-yl]thio]-. Following Lipinski's Rule of Five, Aceticacid, 2-[[2-amino-9-(2-methylbutyl)-9H-purin-6-yl]thio]- has 2 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 Aceticacid, 2-[[2-amino-9-(2-methylbutyl)-9H-purin-6-yl]thio]-?
The CAS number of Aceticacid, 2-[[2-amino-9-(2-methylbutyl)-9H-purin-6-yl]thio]- is 91647-49-3.
What is the molecular formula of Aceticacid, 2-[[2-amino-9-(2-methylbutyl)-9H-purin-6-yl]thio]-?
The molecular formula of Aceticacid, 2-[[2-amino-9-(2-methylbutyl)-9H-purin-6-yl]thio]- is C12H17N5O2S.
What is the molecular weight of Aceticacid, 2-[[2-amino-9-(2-methylbutyl)-9H-purin-6-yl]thio]-?
The molecular weight of Aceticacid, 2-[[2-amino-9-(2-methylbutyl)-9H-purin-6-yl]thio]- is 295.11 g/mol.
Where can I buy Aceticacid, 2-[[2-amino-9-(2-methylbutyl)-9H-purin-6-yl]thio]-?
You can request a quote for Aceticacid, 2-[[2-amino-9-(2-methylbutyl)-9H-purin-6-yl]thio]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aceticacid, 2-[[2-amino-9-(2-methylbutyl)-9H-purin-6-yl]thio]-?
Yes, KEHONG BIO provides custom synthesis services for Aceticacid, 2-[[2-amino-9-(2-methylbutyl)-9H-purin-6-yl]thio]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.