![Butyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate structure](/static/products/2337/23374-49-4.webp)
Butyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate
TL;DR: Butyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate (CAS 23374-49-4) is a chemical compound with molecular formula C16H23N5O3S and molecular weight 365.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate
Also Known As: J1.610.671B, Butyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate, BUTYL ((5-(9H-PURIN-6-YLTHIO)PENTANOYL)AMINO)ACETATE, N-[5-(1H-Purine-6-ylthio)pentanoyl]glycine butyl ester, Butyl N-{5-[(9H-purin-6-yl)sulfanyl]pentanoyl}glycinate
| Molecular Formula | C16H23N5O3S |
|---|---|
| Molecular Weight | 365.15 g/mol |
| LogP | 2.0748 |
| Topological Polar Surface Area | 109.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 365.15216 |
| Heavy Atoms | 25 |
| Complexity | 691.21497 |
Chemical Identifiers
| CAS Number | 23374-49-4 |
|---|---|
| SMILES | CCCCOC(=O)CNC(=O)CCCCSC1=NC=NC2=C1NC=N2 |
Product Overview
Butyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate (CAS 23374-49-4), with molecular formula C16H23N5O3S and molecular weight 365.15 g/mol. IUPAC: butyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate.
Chemical Property Profile of Butyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate
Property Insights of Butyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate
The XLogP value of 2.0748 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate. The TPSA of 109.86 Ų falls within the moderate polarity range, balancing permeability and solubility for Butyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate. Following Lipinski's Rule of Five, Butyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate 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 Butyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate?
The CAS number of Butyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate is 23374-49-4.
What is the molecular formula of Butyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate?
The molecular formula of Butyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate is C16H23N5O3S.
What is the molecular weight of Butyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate?
The molecular weight of Butyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate is 365.15 g/mol.
Where can I buy Butyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate?
You can request a quote for Butyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate?
Yes, KEHONG BIO provides custom synthesis services for Butyl 2-[5-(7H-purin-6-ylsulfanyl)pentanoylamino]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.