![8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]purine-2,6-dione structure](/static/products/6729/672933-87-8.webp)
8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]purine-2,6-dione
TL;DR: 8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]purine-2,6-dione (CAS 672933-87-8) is a chemical compound with molecular formula C20H22N8O4S2 and molecular weight 502.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]purine-2,6-dione
Also Known As: 8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]purine-2,6-dione, 8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methyl-7-{2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl}-2,3,6,7-tetrahydro-1H-purine-2,6-dione, 8-[4-(2-furylcarbonyl)piperazinyl]-3-methyl-7-[2-(5-methyl(1,3,4-thiadiazol-2- ylthio))ethyl]-1,3,7-trihydropurine-2,6-dione, 8-[4-(2-Furylcarbonyl)piperazinyl]-3-methyl-7-[2-(5-methyl(1,3,4-thiadiazol-2-ylthio))ethyl]-1,3,7-trihydropurine-2,6-dione
| Molecular Formula | C20H22N8O4S2 |
|---|---|
| Molecular Weight | 502.12 g/mol |
| LogP | 0.93092 |
| Topological Polar Surface Area | 135.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 502.12054 |
| Heavy Atoms | 34 |
| Complexity | 1443.5675 |
Chemical Identifiers
| CAS Number | 672933-87-8 |
|---|---|
| SMILES | CC1=NN=C(S1)SCCN2C3=C(N=C2N4CCN(CC4)C(=O)C5=CC=CO5)N(C(=O)NC3=O)C |
Product Overview
8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]purine-2,6-dione (CAS 672933-87-8), with molecular formula C20H22N8O4S2 and molecular weight 502.12 g/mol. IUPAC: 8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]purine-2,6-dione.
Chemical Property Profile of 8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]purine-2,6-dione
Property Insights of 8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]purine-2,6-dione
The XLogP value of 0.93092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]purine-2,6-dione. The TPSA of 135.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]purine-2,6-dione. Following Lipinski's Rule of Five, 8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]purine-2,6-dione has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]purine-2,6-dione?
The CAS number of 8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]purine-2,6-dione is 672933-87-8.
What is the molecular formula of 8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]purine-2,6-dione?
The molecular formula of 8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]purine-2,6-dione is C20H22N8O4S2.
What is the molecular weight of 8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]purine-2,6-dione?
The molecular weight of 8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]purine-2,6-dione is 502.12 g/mol.
Where can I buy 8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]purine-2,6-dione?
You can request a quote for 8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]purine-2,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 8-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.