BAS 01122513
TL;DR: BAS 01122513 (CAS 332103-46-5) is a chemical compound with molecular formula C20H25N5O5 and molecular weight 415.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-8-morpholin-4-ylpurine-2,6-dione
Also Known As: BAS 01122513, 7-(2-hydroxy-3-(o-tolyloxy)propyl)-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione, AB00131500-02, F0374-0035, 7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-8-morpholin-4-ylpurine-2,6-dione
| Molecular Formula | C20H25N5O5 |
|---|---|
| Molecular Weight | 415.19 g/mol |
| LogP | 0.00822 |
| Topological Polar Surface Area | 114.61 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 415.18558 |
| Heavy Atoms | 30 |
| Complexity | 1158.5841 |
Chemical Identifiers
| CAS Number | 332103-46-5 |
|---|---|
| SMILES | CC1=CC=CC=C1OCC(CN2C3=C(N=C2N4CCOCC4)N(C(=O)NC3=O)C)O |
Product Overview
BAS 01122513 (CAS 332103-46-5), with molecular formula C20H25N5O5 and molecular weight 415.19 g/mol. IUPAC: 7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-8-morpholin-4-ylpurine-2,6-dione.
Chemical Property Profile of BAS 01122513
Property Insights of BAS 01122513
The XLogP value of 0.00822 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01122513. The TPSA of 114.61 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01122513. Following Lipinski's Rule of Five, BAS 01122513 has 2 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 01122513?
The CAS number of BAS 01122513 is 332103-46-5.
What is the molecular formula of BAS 01122513?
The molecular formula of BAS 01122513 is C20H25N5O5.
What is the molecular weight of BAS 01122513?
The molecular weight of BAS 01122513 is 415.19 g/mol.
Where can I buy BAS 01122513?
You can request a quote for BAS 01122513 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01122513?
Yes, KEHONG BIO provides custom synthesis services for BAS 01122513 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.