![1H-Purine, 6-[(1-phenylethyl)thio]- structure](/static/products/930/93087-27-5.png)
1H-Purine, 6-[(1-phenylethyl)thio]-
TL;DR: 1H-Purine, 6-[(1-phenylethyl)thio]- (CAS 93087-27-5) is a chemical compound with molecular formula C13H12N4S and molecular weight 256.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(1-phenylethylsulfanyl)-7H-purine
Also Known As: 6-(phenylethylthio)purine, 1H-Purine, 6-[(1-phenylethyl)thio]-, IFLab1_002237, 6-(1-phenylethylsulfanyl)-7H-purine, 6-[(1-phenylethyl)sulfanyl]-9H-purine
| Molecular Formula | C13H12N4S |
|---|---|
| Molecular Weight | 256.08 g/mol |
| LogP | 3.2062 |
| Topological Polar Surface Area | 54.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.07828 |
| Heavy Atoms | 18 |
| Complexity | 650.15985 |
Chemical Identifiers
| CAS Number | 93087-27-5 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)SC2=NC=NC3=C2NC=N3 |
Product Overview
1H-Purine, 6-[(1-phenylethyl)thio]- (CAS 93087-27-5), with molecular formula C13H12N4S and molecular weight 256.08 g/mol. IUPAC: 6-(1-phenylethylsulfanyl)-7H-purine.
Chemical Property Profile of 1H-Purine, 6-[(1-phenylethyl)thio]-
Property Insights of 1H-Purine, 6-[(1-phenylethyl)thio]-
The XLogP value of 3.2062 indicates that 1H-Purine, 6-[(1-phenylethyl)thio]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.46 Ų, 1H-Purine, 6-[(1-phenylethyl)thio]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Purine, 6-[(1-phenylethyl)thio]- has 1 hydrogen bond donor(s) and 4 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 1H-Purine, 6-[(1-phenylethyl)thio]-?
The CAS number of 1H-Purine, 6-[(1-phenylethyl)thio]- is 93087-27-5.
What is the molecular formula of 1H-Purine, 6-[(1-phenylethyl)thio]-?
The molecular formula of 1H-Purine, 6-[(1-phenylethyl)thio]- is C13H12N4S.
What is the molecular weight of 1H-Purine, 6-[(1-phenylethyl)thio]-?
The molecular weight of 1H-Purine, 6-[(1-phenylethyl)thio]- is 256.08 g/mol.
Where can I buy 1H-Purine, 6-[(1-phenylethyl)thio]-?
You can request a quote for 1H-Purine, 6-[(1-phenylethyl)thio]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Purine, 6-[(1-phenylethyl)thio]-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Purine, 6-[(1-phenylethyl)thio]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.