3,7-Dimethyl-8-pyrrolidin-1-yl-3,7-dihydro-purine-2,6-dione
TL;DR: 3,7-Dimethyl-8-pyrrolidin-1-yl-3,7-dihydro-purine-2,6-dione (CAS 30958-54-4) is a chemical compound with molecular formula C11H15N5O2 and molecular weight 249.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,7-dimethyl-8-pyrrolidin-1-ylpurine-2,6-dione
Also Known As: BAS 06502948, 3,7-dimethyl-8-pyrrolidin-1-ylpurine-2,6-dione, 3,7-Dimethyl-8-pyrrolidin-1-yl-3,7-dihydro-purine-2,6-dione, 3,7-dimethyl-8-(1-pyrrolidinyl)-3,7-dihydro-1h-purine-2,6-dione
| Molecular Formula | C11H15N5O2 |
|---|---|
| Molecular Weight | 249.12 g/mol |
| LogP | -0.4395 |
| Topological Polar Surface Area | 75.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 249.12257 |
| Heavy Atoms | 18 |
| Complexity | 717.3344 |
Chemical Identifiers
| CAS Number | 30958-54-4 |
|---|---|
| SMILES | CN1C2=C(N=C1N3CCCC3)N(C(=O)NC2=O)C |
Product Overview
3,7-Dimethyl-8-pyrrolidin-1-yl-3,7-dihydro-purine-2,6-dione (CAS 30958-54-4), with molecular formula C11H15N5O2 and molecular weight 249.12 g/mol. IUPAC: 3,7-dimethyl-8-pyrrolidin-1-ylpurine-2,6-dione.
Chemical Property Profile of 3,7-Dimethyl-8-pyrrolidin-1-yl-3,7-dihydro-purine-2,6-dione
Property Insights of 3,7-Dimethyl-8-pyrrolidin-1-yl-3,7-dihydro-purine-2,6-dione
The XLogP value of -0.4395 indicates that 3,7-Dimethyl-8-pyrrolidin-1-yl-3,7-dihydro-purine-2,6-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 75.92 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,7-Dimethyl-8-pyrrolidin-1-yl-3,7-dihydro-purine-2,6-dione. Following Lipinski's Rule of Five, 3,7-Dimethyl-8-pyrrolidin-1-yl-3,7-dihydro-purine-2,6-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 3,7-Dimethyl-8-pyrrolidin-1-yl-3,7-dihydro-purine-2,6-dione?
The CAS number of 3,7-Dimethyl-8-pyrrolidin-1-yl-3,7-dihydro-purine-2,6-dione is 30958-54-4.
What is the molecular formula of 3,7-Dimethyl-8-pyrrolidin-1-yl-3,7-dihydro-purine-2,6-dione?
The molecular formula of 3,7-Dimethyl-8-pyrrolidin-1-yl-3,7-dihydro-purine-2,6-dione is C11H15N5O2.
What is the molecular weight of 3,7-Dimethyl-8-pyrrolidin-1-yl-3,7-dihydro-purine-2,6-dione?
The molecular weight of 3,7-Dimethyl-8-pyrrolidin-1-yl-3,7-dihydro-purine-2,6-dione is 249.12 g/mol.
Where can I buy 3,7-Dimethyl-8-pyrrolidin-1-yl-3,7-dihydro-purine-2,6-dione?
You can request a quote for 3,7-Dimethyl-8-pyrrolidin-1-yl-3,7-dihydro-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 3,7-Dimethyl-8-pyrrolidin-1-yl-3,7-dihydro-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 3,7-Dimethyl-8-pyrrolidin-1-yl-3,7-dihydro-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.