9H-Purine-6(1H)-thione, 2,9-diethyl-
TL;DR: 9H-Purine-6(1H)-thione, 2,9-diethyl- (CAS 6223-60-5) is a chemical compound with molecular formula C9H12N4S and molecular weight 208.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,9-diethyl-3H-purine-6-thione
Also Known As: 2,9-diethyl-3H-purine-6-thione, 9H-Purine-6(1H)-thione, 2,9-diethyl-, 2,9-Diethyl-3,9-dihydro-6H-purine-6-thione
| Molecular Formula | C9H12N4S |
|---|---|
| Molecular Weight | 208.08 g/mol |
| LogP | 2.07119 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.07826 |
| Heavy Atoms | 14 |
| Complexity | 510.99658 |
Chemical Identifiers
| CAS Number | 6223-60-5 |
|---|---|
| SMILES | CCC1=NC(=S)C2=C(N1)N(C=N2)CC |
Product Overview
9H-Purine-6(1H)-thione, 2,9-diethyl- (CAS 6223-60-5), with molecular formula C9H12N4S and molecular weight 208.08 g/mol. IUPAC: 2,9-diethyl-3H-purine-6-thione.
Chemical Property Profile of 9H-Purine-6(1H)-thione, 2,9-diethyl-
Property Insights of 9H-Purine-6(1H)-thione, 2,9-diethyl-
The XLogP value of 2.07119 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9H-Purine-6(1H)-thione, 2,9-diethyl-. With a topological polar surface area (TPSA) of 46.5 Ų, 9H-Purine-6(1H)-thione, 2,9-diethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9H-Purine-6(1H)-thione, 2,9-diethyl- has 1 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 9H-Purine-6(1H)-thione, 2,9-diethyl-?
The CAS number of 9H-Purine-6(1H)-thione, 2,9-diethyl- is 6223-60-5.
What is the molecular formula of 9H-Purine-6(1H)-thione, 2,9-diethyl-?
The molecular formula of 9H-Purine-6(1H)-thione, 2,9-diethyl- is C9H12N4S.
What is the molecular weight of 9H-Purine-6(1H)-thione, 2,9-diethyl-?
The molecular weight of 9H-Purine-6(1H)-thione, 2,9-diethyl- is 208.08 g/mol.
Where can I buy 9H-Purine-6(1H)-thione, 2,9-diethyl-?
You can request a quote for 9H-Purine-6(1H)-thione, 2,9-diethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9H-Purine-6(1H)-thione, 2,9-diethyl-?
Yes, KEHONG BIO provides custom synthesis services for 9H-Purine-6(1H)-thione, 2,9-diethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.