BAS 08333513
TL;DR: BAS 08333513 (CAS 309937-33-5) is a chemical compound with molecular formula C17H20ClN5O3 and molecular weight 377.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(2-chlorophenyl)methyl]-8-(2-methoxyethylamino)-1,3-dimethylpurine-2,6-dione
Also Known As: BAS 08333513, 7-(2-chlorobenzyl)-8-[(2-methoxyethyl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione, 7-(2-chlorobenzyl)-8-((2-methoxyethyl)amino)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, 7-[(2-chlorophenyl)methyl]-8-(2-methoxyethylamino)-1,3-dimethylpurine-2,6-dione, 7-[(2-chlorophenyl)methyl]-8-[(2-methoxyethyl)amino]-1,3-dimethyl-1,3,7-trihyd ropurine-2,6-dione
| Molecular Formula | C17H20ClN5O3 |
|---|---|
| Molecular Weight | 377.13 g/mol |
| LogP | 1.1937 |
| Topological Polar Surface Area | 83.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 377.12546 |
| Heavy Atoms | 26 |
| Complexity | 1066.6711 |
Chemical Identifiers
| CAS Number | 309937-33-5 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCCOC)CC3=CC=CC=C3Cl |
Product Overview
BAS 08333513 (CAS 309937-33-5), with molecular formula C17H20ClN5O3 and molecular weight 377.13 g/mol. IUPAC: 7-[(2-chlorophenyl)methyl]-8-(2-methoxyethylamino)-1,3-dimethylpurine-2,6-dione.
Chemical Property Profile of BAS 08333513
Property Insights of BAS 08333513
The XLogP value of 1.1937 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 08333513. The TPSA of 83.08 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 08333513. Following Lipinski's Rule of Five, BAS 08333513 has 1 hydrogen bond donor(s) and 5 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 08333513?
The CAS number of BAS 08333513 is 309937-33-5.
What is the molecular formula of BAS 08333513?
The molecular formula of BAS 08333513 is C17H20ClN5O3.
What is the molecular weight of BAS 08333513?
The molecular weight of BAS 08333513 is 377.13 g/mol.
Where can I buy BAS 08333513?
You can request a quote for BAS 08333513 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 08333513?
Yes, KEHONG BIO provides custom synthesis services for BAS 08333513 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.