BAS 05022064
TL;DR: BAS 05022064 (CAS 510735-05-4) is a chemical compound with molecular formula C22H19FN4O5 and molecular weight 438.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(1,3-benzodioxol-5-ylmethoxy)-1-[(2-fluorophenyl)methyl]-3,7-dimethylpurine-2,6-dione
Also Known As: BAS 05022064, AO-343/41781104, 8-(1,3-benzodioxol-5-ylmethoxy)-1-[(2-fluorophenyl)methyl]-3,7-dimethylpurine-2,6-dione, 8-(1,3-benzodioxol-5-ylmethoxy)-1-(2-fluorobenzyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C22H19FN4O5 |
|---|---|
| Molecular Weight | 438.13 g/mol |
| LogP | 1.9288 |
| Topological Polar Surface Area | 89.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 438.13394 |
| Heavy Atoms | 32 |
| Complexity | 1469.9358 |
Chemical Identifiers
| CAS Number | 510735-05-4 |
|---|---|
| SMILES | CN1C2=C(N=C1OCC3=CC4=C(C=C3)OCO4)N(C(=O)N(C2=O)CC5=CC=CC=C5F)C |
Product Overview
BAS 05022064 (CAS 510735-05-4), with molecular formula C22H19FN4O5 and molecular weight 438.13 g/mol. IUPAC: 8-(1,3-benzodioxol-5-ylmethoxy)-1-[(2-fluorophenyl)methyl]-3,7-dimethylpurine-2,6-dione.
Chemical Property Profile of BAS 05022064
Property Insights of BAS 05022064
The XLogP value of 1.9288 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 05022064. The TPSA of 89.51 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05022064. Following Lipinski's Rule of Five, BAS 05022064 has 0 hydrogen bond donor(s) and 6 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 BAS 05022064?
The CAS number of BAS 05022064 is 510735-05-4.
What is the molecular formula of BAS 05022064?
The molecular formula of BAS 05022064 is C22H19FN4O5.
What is the molecular weight of BAS 05022064?
The molecular weight of BAS 05022064 is 438.13 g/mol.
Where can I buy BAS 05022064?
You can request a quote for BAS 05022064 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05022064?
Yes, KEHONG BIO provides custom synthesis services for BAS 05022064 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.