1-(3,5-Dioxopyrazolidin-4-yl)-3,7-dimethylpurine-2,6-dione
TL;DR: 1-(3,5-Dioxopyrazolidin-4-yl)-3,7-dimethylpurine-2,6-dione (CAS 62787-56-8) is a chemical compound with molecular formula C10H10N6O4 and molecular weight 278.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,5-dioxopyrazolidin-4-yl)-3,7-dimethylpurine-2,6-dione
Also Known As: 1-(3,5-dioxopyrazolidin-4-yl)-3,7-dimethylpurine-2,6-dione, 1-(3,5-Dioxopyrazolidin-4-yl)-3,7-dimethyl-purine-2,6-dione, 1-(3,5-Dioxopyrazolidin-4-yl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C10H10N6O4 |
|---|---|
| Molecular Weight | 278.08 g/mol |
| LogP | -1.2 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 278.07635 |
| Heavy Atoms | 20 |
| Complexity | 506.0 |
Chemical Identifiers
| CAS Number | 62787-56-8 |
|---|---|
| SMILES | CN1C=NC2=C1C(=O)N(C(=O)N2C)C3C(=O)NNC3=O |
| InChIKey | WTTCEWRPMAIDLN-UHFFFAOYSA-N |
Product Overview
1-(3,5-Dioxopyrazolidin-4-yl)-3,7-dimethylpurine-2,6-dione (CAS 62787-56-8), with molecular formula C10H10N6O4 and molecular weight 278.08 g/mol. IUPAC: 1-(3,5-dioxopyrazolidin-4-yl)-3,7-dimethylpurine-2,6-dione.
Chemical Property Profile of 1-(3,5-Dioxopyrazolidin-4-yl)-3,7-dimethylpurine-2,6-dione
Property Insights of 1-(3,5-Dioxopyrazolidin-4-yl)-3,7-dimethylpurine-2,6-dione
The XLogP value of -1.2 indicates that 1-(3,5-Dioxopyrazolidin-4-yl)-3,7-dimethylpurine-2,6-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3,5-Dioxopyrazolidin-4-yl)-3,7-dimethylpurine-2,6-dione. Following Lipinski's Rule of Five, 1-(3,5-Dioxopyrazolidin-4-yl)-3,7-dimethylpurine-2,6-dione has 2 hydrogen bond donor(s) and 5 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 1-(3,5-Dioxopyrazolidin-4-yl)-3,7-dimethylpurine-2,6-dione?
The CAS number of 1-(3,5-Dioxopyrazolidin-4-yl)-3,7-dimethylpurine-2,6-dione is 62787-56-8.
What is the molecular formula of 1-(3,5-Dioxopyrazolidin-4-yl)-3,7-dimethylpurine-2,6-dione?
The molecular formula of 1-(3,5-Dioxopyrazolidin-4-yl)-3,7-dimethylpurine-2,6-dione is C10H10N6O4.
What is the molecular weight of 1-(3,5-Dioxopyrazolidin-4-yl)-3,7-dimethylpurine-2,6-dione?
The molecular weight of 1-(3,5-Dioxopyrazolidin-4-yl)-3,7-dimethylpurine-2,6-dione is 278.08 g/mol.
Where can I buy 1-(3,5-Dioxopyrazolidin-4-yl)-3,7-dimethylpurine-2,6-dione?
You can request a quote for 1-(3,5-Dioxopyrazolidin-4-yl)-3,7-dimethylpurine-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 1-(3,5-Dioxopyrazolidin-4-yl)-3,7-dimethylpurine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,5-Dioxopyrazolidin-4-yl)-3,7-dimethylpurine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.