![9-[2-(diethylamino)ethyl]-3H-purine-2,6-dithione structure](/static/products/6981/69818-44-6.webp)
9-[2-(diethylamino)ethyl]-3H-purine-2,6-dithione
TL;DR: 9-[2-(diethylamino)ethyl]-3H-purine-2,6-dithione (CAS 69818-44-6) is a chemical compound with molecular formula C11H17N5S2 and molecular weight 283.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-[2-(diethylamino)ethyl]-3H-purine-2,6-dithione
Also Known As: 9-[2-(diethylamino)ethyl]-3H-purine-2,6-dithione, 9-(2-diethylaminoethyl)-3H-purine-2,6-dithione, 9-[2-(Diethylamino)ethyl]-3,9-dihydro-1H-purine-2,6-dithione, 1H-PURINE-2,6-DITHIONE,9-[2-(DIETHYLAMINO)ETHYL]-3,9-DIHYDRO-
| Molecular Formula | C11H17N5S2 |
|---|---|
| Molecular Weight | 283.09 g/mol |
| LogP | 2.49328 |
| Topological Polar Surface Area | 52.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 283.09253 |
| Heavy Atoms | 18 |
| Complexity | 634.6564 |
Chemical Identifiers
| CAS Number | 69818-44-6 |
|---|---|
| SMILES | CCN(CC)CCN1C=NC2=C1NC(=S)NC2=S |
Product Overview
9-[2-(diethylamino)ethyl]-3H-purine-2,6-dithione (CAS 69818-44-6), with molecular formula C11H17N5S2 and molecular weight 283.09 g/mol. IUPAC: 9-[2-(diethylamino)ethyl]-3H-purine-2,6-dithione.
Chemical Property Profile of 9-[2-(diethylamino)ethyl]-3H-purine-2,6-dithione
Property Insights of 9-[2-(diethylamino)ethyl]-3H-purine-2,6-dithione
The XLogP value of 2.49328 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-[2-(diethylamino)ethyl]-3H-purine-2,6-dithione. With a topological polar surface area (TPSA) of 52.64 Ų, 9-[2-(diethylamino)ethyl]-3H-purine-2,6-dithione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-[2-(diethylamino)ethyl]-3H-purine-2,6-dithione has 2 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-[2-(diethylamino)ethyl]-3H-purine-2,6-dithione?
The CAS number of 9-[2-(diethylamino)ethyl]-3H-purine-2,6-dithione is 69818-44-6.
What is the molecular formula of 9-[2-(diethylamino)ethyl]-3H-purine-2,6-dithione?
The molecular formula of 9-[2-(diethylamino)ethyl]-3H-purine-2,6-dithione is C11H17N5S2.
What is the molecular weight of 9-[2-(diethylamino)ethyl]-3H-purine-2,6-dithione?
The molecular weight of 9-[2-(diethylamino)ethyl]-3H-purine-2,6-dithione is 283.09 g/mol.
Where can I buy 9-[2-(diethylamino)ethyl]-3H-purine-2,6-dithione?
You can request a quote for 9-[2-(diethylamino)ethyl]-3H-purine-2,6-dithione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-[2-(diethylamino)ethyl]-3H-purine-2,6-dithione?
Yes, KEHONG BIO provides custom synthesis services for 9-[2-(diethylamino)ethyl]-3H-purine-2,6-dithione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.