1-Ethyl-9-methyl-3-propyl-3,9-dihydro-1h-purine-2,6-dione
TL;DR: 1-Ethyl-9-methyl-3-propyl-3,9-dihydro-1h-purine-2,6-dione (CAS 3637-14-7) is a chemical compound with molecular formula C11H16N4O2 and molecular weight 236.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-9-methyl-3-propylpurine-2,6-dione
Also Known As: 1-ethyl-9-methyl-3-propylpurine-2,6-dione, 1-ethyl-9-methyl-3-propyl-3,9-dihydro-1h-purine-2,6-dione, 1H-Purine-2,6-dione,1-ethyl-3,9-dihydro-9-methyl-3-propyl-
| Molecular Formula | C11H16N4O2 |
|---|---|
| Molecular Weight | 236.13 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 58.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.12732 |
| Heavy Atoms | 17 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 3637-14-7 |
|---|---|
| SMILES | CCCN1C2=C(C(=O)N(C1=O)CC)N=CN2C |
| InChIKey | JMKSRXLZHUWCDQ-UHFFFAOYSA-N |
Product Overview
1-Ethyl-9-methyl-3-propyl-3,9-dihydro-1h-purine-2,6-dione (CAS 3637-14-7), with molecular formula C11H16N4O2 and molecular weight 236.13 g/mol. IUPAC: 1-ethyl-9-methyl-3-propylpurine-2,6-dione.
Chemical Property Profile of 1-Ethyl-9-methyl-3-propyl-3,9-dihydro-1h-purine-2,6-dione
Property Insights of 1-Ethyl-9-methyl-3-propyl-3,9-dihydro-1h-purine-2,6-dione
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Ethyl-9-methyl-3-propyl-3,9-dihydro-1h-purine-2,6-dione. With a topological polar surface area (TPSA) of 58.4 Ų, 1-Ethyl-9-methyl-3-propyl-3,9-dihydro-1h-purine-2,6-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethyl-9-methyl-3-propyl-3,9-dihydro-1h-purine-2,6-dione has 0 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 1-Ethyl-9-methyl-3-propyl-3,9-dihydro-1h-purine-2,6-dione?
The CAS number of 1-Ethyl-9-methyl-3-propyl-3,9-dihydro-1h-purine-2,6-dione is 3637-14-7.
What is the molecular formula of 1-Ethyl-9-methyl-3-propyl-3,9-dihydro-1h-purine-2,6-dione?
The molecular formula of 1-Ethyl-9-methyl-3-propyl-3,9-dihydro-1h-purine-2,6-dione is C11H16N4O2.
What is the molecular weight of 1-Ethyl-9-methyl-3-propyl-3,9-dihydro-1h-purine-2,6-dione?
The molecular weight of 1-Ethyl-9-methyl-3-propyl-3,9-dihydro-1h-purine-2,6-dione is 236.13 g/mol.
Where can I buy 1-Ethyl-9-methyl-3-propyl-3,9-dihydro-1h-purine-2,6-dione?
You can request a quote for 1-Ethyl-9-methyl-3-propyl-3,9-dihydro-1h-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 1-Ethyl-9-methyl-3-propyl-3,9-dihydro-1h-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethyl-9-methyl-3-propyl-3,9-dihydro-1h-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.