6-(phenylsulfanylmethyl)-7H-purine
TL;DR: 6-(phenylsulfanylmethyl)-7H-purine (CAS 3389-37-5) is a chemical compound with molecular formula C12H10N4S and molecular weight 242.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(phenylsulfanylmethyl)-7H-purine
Also Known As: 6-(phenylsulfanylmethyl)-7H-purine, 9H-PURINE,6-[(PHENYLTHIO)METHYL]-, 6-[(PHENYLSULFANYL)METHYL]-7H-PURINE
| Molecular Formula | C12H10N4S |
|---|---|
| Molecular Weight | 242.06 g/mol |
| LogP | 2.6452 |
| Topological Polar Surface Area | 54.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 242.06262 |
| Heavy Atoms | 17 |
| Complexity | 620.4967 |
Chemical Identifiers
| CAS Number | 3389-37-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)SCC2=C3C(=NC=N2)N=CN3 |
Product Overview
6-(phenylsulfanylmethyl)-7H-purine (CAS 3389-37-5), with molecular formula C12H10N4S and molecular weight 242.06 g/mol. IUPAC: 6-(phenylsulfanylmethyl)-7H-purine.
Chemical Property Profile of 6-(phenylsulfanylmethyl)-7H-purine
Property Insights of 6-(phenylsulfanylmethyl)-7H-purine
The XLogP value of 2.6452 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(phenylsulfanylmethyl)-7H-purine. With a topological polar surface area (TPSA) of 54.46 Ų, 6-(phenylsulfanylmethyl)-7H-purine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(phenylsulfanylmethyl)-7H-purine 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 6-(phenylsulfanylmethyl)-7H-purine?
The CAS number of 6-(phenylsulfanylmethyl)-7H-purine is 3389-37-5.
What is the molecular formula of 6-(phenylsulfanylmethyl)-7H-purine?
The molecular formula of 6-(phenylsulfanylmethyl)-7H-purine is C12H10N4S.
What is the molecular weight of 6-(phenylsulfanylmethyl)-7H-purine?
The molecular weight of 6-(phenylsulfanylmethyl)-7H-purine is 242.06 g/mol.
Where can I buy 6-(phenylsulfanylmethyl)-7H-purine?
You can request a quote for 6-(phenylsulfanylmethyl)-7H-purine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(phenylsulfanylmethyl)-7H-purine?
Yes, KEHONG BIO provides custom synthesis services for 6-(phenylsulfanylmethyl)-7H-purine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.