8-(diethylamino)-7-dodecyl-3-methyl-1H-purine-2,6(3H,7H)-dione
TL;DR: 8-(diethylamino)-7-dodecyl-3-methyl-1H-purine-2,6(3H,7H)-dione (CAS 312924-15-5) is a chemical compound with molecular formula C22H39N5O2 and molecular weight 405.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(diethylamino)-7-dodecyl-3-methylpurine-2,6-dione
Also Known As: BAS 00387068, 8-(diethylamino)-7-dodecyl-3-methyl-1H-purine-2,6(3H,7H)-dione, 8-(diethylamino)-7-dodecyl-3-methylpurine-2,6-dione, 8-(diethylamino)-7-dodecyl-3-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione, F0053-0046
| Molecular Formula | C22H39N5O2 |
|---|---|
| Molecular Weight | 405.31 g/mol |
| LogP | 4.1904 |
| Topological Polar Surface Area | 75.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 14 |
| Exact Mass | 405.31036 |
| Heavy Atoms | 29 |
| Complexity | 860.43536 |
Chemical Identifiers
| CAS Number | 312924-15-5 |
|---|---|
| SMILES | CCCCCCCCCCCCN1C2=C(N=C1N(CC)CC)N(C(=O)NC2=O)C |
Product Overview
8-(diethylamino)-7-dodecyl-3-methyl-1H-purine-2,6(3H,7H)-dione (CAS 312924-15-5), with molecular formula C22H39N5O2 and molecular weight 405.31 g/mol. IUPAC: 8-(diethylamino)-7-dodecyl-3-methylpurine-2,6-dione.
Chemical Property Profile of 8-(diethylamino)-7-dodecyl-3-methyl-1H-purine-2,6(3H,7H)-dione
Property Insights of 8-(diethylamino)-7-dodecyl-3-methyl-1H-purine-2,6(3H,7H)-dione
The XLogP value of 4.1904 indicates that 8-(diethylamino)-7-dodecyl-3-methyl-1H-purine-2,6(3H,7H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.92 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-(diethylamino)-7-dodecyl-3-methyl-1H-purine-2,6(3H,7H)-dione. Following Lipinski's Rule of Five, 8-(diethylamino)-7-dodecyl-3-methyl-1H-purine-2,6(3H,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 8-(diethylamino)-7-dodecyl-3-methyl-1H-purine-2,6(3H,7H)-dione?
The CAS number of 8-(diethylamino)-7-dodecyl-3-methyl-1H-purine-2,6(3H,7H)-dione is 312924-15-5.
What is the molecular formula of 8-(diethylamino)-7-dodecyl-3-methyl-1H-purine-2,6(3H,7H)-dione?
The molecular formula of 8-(diethylamino)-7-dodecyl-3-methyl-1H-purine-2,6(3H,7H)-dione is C22H39N5O2.
What is the molecular weight of 8-(diethylamino)-7-dodecyl-3-methyl-1H-purine-2,6(3H,7H)-dione?
The molecular weight of 8-(diethylamino)-7-dodecyl-3-methyl-1H-purine-2,6(3H,7H)-dione is 405.31 g/mol.
Where can I buy 8-(diethylamino)-7-dodecyl-3-methyl-1H-purine-2,6(3H,7H)-dione?
You can request a quote for 8-(diethylamino)-7-dodecyl-3-methyl-1H-purine-2,6(3H,7H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-(diethylamino)-7-dodecyl-3-methyl-1H-purine-2,6(3H,7H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 8-(diethylamino)-7-dodecyl-3-methyl-1H-purine-2,6(3H,7H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.