methanol structure](/static/products/4244/4244-51-3.webp)
[2-(Methylsulfanyl)-7h-purin-8-yl](phenyl)methanol
TL;DR: [2-(Methylsulfanyl)-7h-purin-8-yl](phenyl)methanol (CAS 4244-51-3) is a chemical compound with molecular formula C13H12N4OS and molecular weight 272.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methylsulfanyl-7H-purin-8-yl)-phenylmethanol
Also Known As: NCIOpen2_004426, (2-methylsulfanyl-7H-purin-8-yl)-phenylmethanol, [2-(methylsulfanyl)-7h-purin-8-yl](phenyl)methanol, (2-(Methylthio)-9H-purin-8-yl)(phenyl)methanol, 9H-Purine-8-methanol,2-(methylthio)-a-phenyl-
| Molecular Formula | C13H12N4OS |
|---|---|
| Molecular Weight | 272.07 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 272.07318 |
| Heavy Atoms | 19 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 4244-51-3 |
|---|---|
| SMILES | CSC1=NC=C2C(=N1)N=C(N2)C(C3=CC=CC=C3)O |
| InChIKey | GTRCHOWLVXZROM-UHFFFAOYSA-N |
Product Overview
[2-(Methylsulfanyl)-7h-purin-8-yl](phenyl)methanol (CAS 4244-51-3), with molecular formula C13H12N4OS and molecular weight 272.07 g/mol. IUPAC: (2-methylsulfanyl-7H-purin-8-yl)-phenylmethanol.
Chemical Property Profile of [2-(Methylsulfanyl)-7h-purin-8-yl](phenyl)methanol
Property Insights of [2-(Methylsulfanyl)-7h-purin-8-yl](phenyl)methanol
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(Methylsulfanyl)-7h-purin-8-yl](phenyl)methanol. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(Methylsulfanyl)-7h-purin-8-yl](phenyl)methanol. Following Lipinski's Rule of Five, [2-(Methylsulfanyl)-7h-purin-8-yl](phenyl)methanol has 2 hydrogen bond donor(s) and 5 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 [2-(Methylsulfanyl)-7h-purin-8-yl](phenyl)methanol?
The CAS number of [2-(Methylsulfanyl)-7h-purin-8-yl](phenyl)methanol is 4244-51-3.
What is the molecular formula of [2-(Methylsulfanyl)-7h-purin-8-yl](phenyl)methanol?
The molecular formula of [2-(Methylsulfanyl)-7h-purin-8-yl](phenyl)methanol is C13H12N4OS.
What is the molecular weight of [2-(Methylsulfanyl)-7h-purin-8-yl](phenyl)methanol?
The molecular weight of [2-(Methylsulfanyl)-7h-purin-8-yl](phenyl)methanol is 272.07 g/mol.
Where can I buy [2-(Methylsulfanyl)-7h-purin-8-yl](phenyl)methanol?
You can request a quote for [2-(Methylsulfanyl)-7h-purin-8-yl](phenyl)methanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(Methylsulfanyl)-7h-purin-8-yl](phenyl)methanol?
Yes, KEHONG BIO provides custom synthesis services for [2-(Methylsulfanyl)-7h-purin-8-yl](phenyl)methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.