AB00431439-08
TL;DR: AB00431439-08 (CAS 851941-32-7) is a chemical compound with molecular formula C18H30N6O4 and molecular weight 394.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(2-ethoxyethyl)-8-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-1,3-dimethylpurine-2,6-dione
Also Known As: AB00431439-08, 7-(2-ethoxyethyl)-8-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione, 7-(2-ethoxyethyl)-8-((4-(2-hydroxyethyl)piperazin-1-yl)methyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, 7-(2-ethoxyethyl)-8-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-1,3-dimethylpurine-2,6-dione, 7-(2-ETHOXYETHYL)-8-{[4-(2-HYDROXYETHYL)PIPERAZIN-1-YL]METHYL}-1,3-DIMETHYL-2,3,6,7-TETRAHYDRO-1H-PURINE-2,6-DIONE
| Molecular Formula | C18H30N6O4 |
|---|---|
| Molecular Weight | 394.23 g/mol |
| LogP | -1.4199 |
| Topological Polar Surface Area | 97.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 394.23285 |
| Heavy Atoms | 28 |
| Complexity | 922.7695 |
Chemical Identifiers
| CAS Number | 851941-32-7 |
|---|---|
| SMILES | CCOCCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN3CCN(CC3)CCO |
Product Overview
AB00431439-08 (CAS 851941-32-7), with molecular formula C18H30N6O4 and molecular weight 394.23 g/mol. IUPAC: 7-(2-ethoxyethyl)-8-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-1,3-dimethylpurine-2,6-dione.
Chemical Property Profile of AB00431439-08
Property Insights of AB00431439-08
The XLogP value of -1.4199 indicates that AB00431439-08 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 97.76 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00431439-08. Following Lipinski's Rule of Five, AB00431439-08 has 1 hydrogen bond donor(s) and 7 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 AB00431439-08?
The CAS number of AB00431439-08 is 851941-32-7.
What is the molecular formula of AB00431439-08?
The molecular formula of AB00431439-08 is C18H30N6O4.
What is the molecular weight of AB00431439-08?
The molecular weight of AB00431439-08 is 394.23 g/mol.
Where can I buy AB00431439-08?
You can request a quote for AB00431439-08 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00431439-08?
Yes, KEHONG BIO provides custom synthesis services for AB00431439-08 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.