7-Ethylisoxazolo(3,4-d)pyrimidine-4,6(5H,7H)-dione
TL;DR: 7-Ethylisoxazolo(3,4-d)pyrimidine-4,6(5H,7H)-dione (CAS 65183-61-1) is a chemical compound with molecular formula C7H7N3O3 and molecular weight 181.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-ethyl-[1,2]oxazolo[3,4-d]pyrimidine-4,6-dione
Also Known As: 7-Ethylisoxazolo(3,4-d)pyrimidine-4,6(5H,7H)-dione, 7-ethyl-[1,2]oxazolo[3,4-d]pyrimidine-4,6-dione, 7-Ethylisoxazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione, 7-ethylisoxazolo[3,4-d]pyrimidine-4,6-dione, 7-ethyl-7H-isoxazolo[3,4-d]pyrimidine-4,6-dione
| Molecular Formula | C7H7N3O3 |
|---|---|
| Molecular Weight | 181.05 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 75.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 181.04874 |
| Heavy Atoms | 13 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 65183-61-1 |
|---|---|
| SMILES | CCN1C2=NOC=C2C(=O)NC1=O |
| InChIKey | GTMGELLVPUSBMG-UHFFFAOYSA-N |
Product Overview
7-Ethylisoxazolo(3,4-d)pyrimidine-4,6(5H,7H)-dione (CAS 65183-61-1), with molecular formula C7H7N3O3 and molecular weight 181.05 g/mol. IUPAC: 7-ethyl-[1,2]oxazolo[3,4-d]pyrimidine-4,6-dione.
Chemical Property Profile of 7-Ethylisoxazolo(3,4-d)pyrimidine-4,6(5H,7H)-dione
Property Insights of 7-Ethylisoxazolo(3,4-d)pyrimidine-4,6(5H,7H)-dione
The XLogP value of -0.2 indicates that 7-Ethylisoxazolo(3,4-d)pyrimidine-4,6(5H,7H)-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Ethylisoxazolo(3,4-d)pyrimidine-4,6(5H,7H)-dione. Following Lipinski's Rule of Five, 7-Ethylisoxazolo(3,4-d)pyrimidine-4,6(5H,7H)-dione 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 7-Ethylisoxazolo(3,4-d)pyrimidine-4,6(5H,7H)-dione?
The CAS number of 7-Ethylisoxazolo(3,4-d)pyrimidine-4,6(5H,7H)-dione is 65183-61-1.
What is the molecular formula of 7-Ethylisoxazolo(3,4-d)pyrimidine-4,6(5H,7H)-dione?
The molecular formula of 7-Ethylisoxazolo(3,4-d)pyrimidine-4,6(5H,7H)-dione is C7H7N3O3.
What is the molecular weight of 7-Ethylisoxazolo(3,4-d)pyrimidine-4,6(5H,7H)-dione?
The molecular weight of 7-Ethylisoxazolo(3,4-d)pyrimidine-4,6(5H,7H)-dione is 181.05 g/mol.
Where can I buy 7-Ethylisoxazolo(3,4-d)pyrimidine-4,6(5H,7H)-dione?
You can request a quote for 7-Ethylisoxazolo(3,4-d)pyrimidine-4,6(5H,7H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Ethylisoxazolo(3,4-d)pyrimidine-4,6(5H,7H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-Ethylisoxazolo(3,4-d)pyrimidine-4,6(5H,7H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.