9-(thiolan-2-yl)-3H-purine-6-thione
TL;DR: 9-(thiolan-2-yl)-3H-purine-6-thione (CAS 90674-21-8) is a chemical compound with molecular formula C9H10N4S2 and molecular weight 238.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(thiolan-2-yl)-3H-purine-6-thione
Also Known As: 9-(thiolan-2-yl)-3H-purine-6-thione, 9-(Thiolan-2-yl)-3,9-dihydro-6H-purine-6-thione, 9-(tetrahydrothiophen-2-yl)-3H-purine-6(9H)-thione
| Molecular Formula | C9H10N4S2 |
|---|---|
| Molecular Weight | 238.03 g/mol |
| LogP | 2.51449 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 238.03468 |
| Heavy Atoms | 15 |
| Complexity | 538.28107 |
Chemical Identifiers
| CAS Number | 90674-21-8 |
|---|---|
| SMILES | C1CC(SC1)N2C=NC3=C2NC=NC3=S |
Product Overview
9-(thiolan-2-yl)-3H-purine-6-thione (CAS 90674-21-8), with molecular formula C9H10N4S2 and molecular weight 238.03 g/mol. IUPAC: 9-(thiolan-2-yl)-3H-purine-6-thione.
Chemical Property Profile of 9-(thiolan-2-yl)-3H-purine-6-thione
Property Insights of 9-(thiolan-2-yl)-3H-purine-6-thione
The XLogP value of 2.51449 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-(thiolan-2-yl)-3H-purine-6-thione. With a topological polar surface area (TPSA) of 46.5 Ų, 9-(thiolan-2-yl)-3H-purine-6-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-(thiolan-2-yl)-3H-purine-6-thione 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 9-(thiolan-2-yl)-3H-purine-6-thione?
The CAS number of 9-(thiolan-2-yl)-3H-purine-6-thione is 90674-21-8.
What is the molecular formula of 9-(thiolan-2-yl)-3H-purine-6-thione?
The molecular formula of 9-(thiolan-2-yl)-3H-purine-6-thione is C9H10N4S2.
What is the molecular weight of 9-(thiolan-2-yl)-3H-purine-6-thione?
The molecular weight of 9-(thiolan-2-yl)-3H-purine-6-thione is 238.03 g/mol.
Where can I buy 9-(thiolan-2-yl)-3H-purine-6-thione?
You can request a quote for 9-(thiolan-2-yl)-3H-purine-6-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-(thiolan-2-yl)-3H-purine-6-thione?
Yes, KEHONG BIO provides custom synthesis services for 9-(thiolan-2-yl)-3H-purine-6-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.