9-propan-2-yl-3H-purine-2,6-dione
TL;DR: 9-propan-2-yl-3H-purine-2,6-dione (CAS 7464-92-8) is a chemical compound with molecular formula C8H10N4O2 and molecular weight 194.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-propan-2-yl-3H-purine-2,6-dione
Also Known As: 9-propan-2-yl-3H-purine-2,6-dione, 9-Isopropyl-1H-purine-2,6(3H,9H)-dione, 9-(Propan-2-yl)-3,9-dihydro-1H-purine-2,6-dione, N/A
| Molecular Formula | C8H10N4O2 |
|---|---|
| Molecular Weight | 194.08 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 194.08037 |
| Heavy Atoms | 14 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 7464-92-8 |
|---|---|
| SMILES | CC(C)N1C=NC2=C1NC(=O)NC2=O |
| InChIKey | NRUPICKXZJJQKQ-UHFFFAOYSA-N |
Product Overview
9-propan-2-yl-3H-purine-2,6-dione (CAS 7464-92-8), with molecular formula C8H10N4O2 and molecular weight 194.08 g/mol. IUPAC: 9-propan-2-yl-3H-purine-2,6-dione.
Chemical Property Profile of 9-propan-2-yl-3H-purine-2,6-dione
Property Insights of 9-propan-2-yl-3H-purine-2,6-dione
The XLogP value of -0.1 indicates that 9-propan-2-yl-3H-purine-2,6-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-propan-2-yl-3H-purine-2,6-dione. Following Lipinski's Rule of Five, 9-propan-2-yl-3H-purine-2,6-dione has 2 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 9-propan-2-yl-3H-purine-2,6-dione?
The CAS number of 9-propan-2-yl-3H-purine-2,6-dione is 7464-92-8.
What is the molecular formula of 9-propan-2-yl-3H-purine-2,6-dione?
The molecular formula of 9-propan-2-yl-3H-purine-2,6-dione is C8H10N4O2.
What is the molecular weight of 9-propan-2-yl-3H-purine-2,6-dione?
The molecular weight of 9-propan-2-yl-3H-purine-2,6-dione is 194.08 g/mol.
Where can I buy 9-propan-2-yl-3H-purine-2,6-dione?
You can request a quote for 9-propan-2-yl-3H-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 9-propan-2-yl-3H-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 9-propan-2-yl-3H-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.