6,7-dihydro-3H-purine-6-thiol
TL;DR: 6,7-dihydro-3H-purine-6-thiol (CAS 68206-96-2) is a chemical compound with molecular formula C5H6N4S and molecular weight 154.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-dihydro-3H-purine-6-thiol
Also Known As: 6,7-dihydro-3H-purine-6-thiol, 1H-Purine-6-thiol,6,7-dihydro, 1H-Purine-6-thiol, 6,7-dihydro-
| Molecular Formula | C5H6N4S |
|---|---|
| Molecular Weight | 154.03 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 54.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 154.03131 |
| Heavy Atoms | 10 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 68206-96-2 |
|---|---|
| SMILES | C1=NC2=C(N1)C(N=CN2)S |
| InChIKey | MMYNJYDWTYJEJU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6,7-dihydro-3H-purine-6-thiol (CAS 68206-96-2), with molecular formula C5H6N4S and molecular weight 154.03 g/mol. IUPAC: 6,7-dihydro-3H-purine-6-thiol.
Chemical Property Profile of 6,7-dihydro-3H-purine-6-thiol
Property Insights of 6,7-dihydro-3H-purine-6-thiol
The XLogP value of -0.3 indicates that 6,7-dihydro-3H-purine-6-thiol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 54.1 Ų, 6,7-dihydro-3H-purine-6-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7-dihydro-3H-purine-6-thiol has 3 hydrogen bond donor(s) and 3 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 6,7-dihydro-3H-purine-6-thiol?
The CAS number of 6,7-dihydro-3H-purine-6-thiol is 68206-96-2.
What is the molecular formula of 6,7-dihydro-3H-purine-6-thiol?
The molecular formula of 6,7-dihydro-3H-purine-6-thiol is C5H6N4S.
What is the molecular weight of 6,7-dihydro-3H-purine-6-thiol?
The molecular weight of 6,7-dihydro-3H-purine-6-thiol is 154.03 g/mol.
Where can I buy 6,7-dihydro-3H-purine-6-thiol?
You can request a quote for 6,7-dihydro-3H-purine-6-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7-dihydro-3H-purine-6-thiol?
Yes, KEHONG BIO provides custom synthesis services for 6,7-dihydro-3H-purine-6-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.