BAS 08333524
TL;DR: BAS 08333524 (CAS 797775-49-6) is a chemical compound with molecular formula C17H15ClN6O2S2 and molecular weight 434.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(2-chlorophenyl)methyl]-1,3-dimethyl-8-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]purine-2,6-dione
Also Known As: BAS 08333524, AB00407538-03, AB00407538-09, 7-(2-Chloro-benzyl)-1,3-dimethyl-8-(5-methyl-[1,3,4]thiadiazol-2-ylsulfanyl)-3,7-dihydro-purine-2,6-dione, 7-(2-chlorobenzyl)-1,3-dimethyl-8-((5-methyl-1,3,4-thiadiazol-2-yl)thio)-1H-purine-2,6(3H,7H)-dione
| Molecular Formula | C17H15ClN6O2S2 |
|---|---|
| Molecular Weight | 434.04 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 138.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 434.03864 |
| Heavy Atoms | 28 |
| Complexity | 630.0 |
Chemical Identifiers
| CAS Number | 797775-49-6 |
|---|---|
| SMILES | CC1=NN=C(S1)SC2=NC3=C(N2CC4=CC=CC=C4Cl)C(=O)N(C(=O)N3C)C |
| InChIKey | SMDITLRYNUIBJO-UHFFFAOYSA-N |
Product Overview
BAS 08333524 (CAS 797775-49-6), with molecular formula C17H15ClN6O2S2 and molecular weight 434.04 g/mol. IUPAC: 7-[(2-chlorophenyl)methyl]-1,3-dimethyl-8-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]purine-2,6-dione.
Chemical Property Profile of BAS 08333524
Property Insights of BAS 08333524
The XLogP value of 3.4 indicates that BAS 08333524 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 08333524. Following Lipinski's Rule of Five, BAS 08333524 has 0 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 BAS 08333524?
The CAS number of BAS 08333524 is 797775-49-6.
What is the molecular formula of BAS 08333524?
The molecular formula of BAS 08333524 is C17H15ClN6O2S2.
What is the molecular weight of BAS 08333524?
The molecular weight of BAS 08333524 is 434.04 g/mol.
Where can I buy BAS 08333524?
You can request a quote for BAS 08333524 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 08333524?
Yes, KEHONG BIO provides custom synthesis services for BAS 08333524 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.