AB00131501-02
TL;DR: AB00131501-02 (CAS 392249-23-9) is a chemical compound with molecular formula C19H24N4O6S and molecular weight 436.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(2,3-dihydroxypropylsulfanyl)-7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methylpurine-2,6-dione
Also Known As: AB00131501-02, F0374-0041, 8-((2,3-dihydroxypropyl)thio)-7-(2-hydroxy-3-(o-tolyloxy)propyl)-3-methyl-1H-purine-2,6(3H,7H)-dione, 8-(2,3-dihydroxypropylsulfanyl)-7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methylpurine-2,6-dione, 8-(2,3-dihydroxypropylsulfanyl)-7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-purine-2,6-dione
| Molecular Formula | C19H24N4O6S |
|---|---|
| Molecular Weight | 436.14 g/mol |
| LogP | -0.38308 |
| Topological Polar Surface Area | 142.6 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 436.14166 |
| Heavy Atoms | 30 |
| Complexity | 1138.2356 |
Chemical Identifiers
| CAS Number | 392249-23-9 |
|---|---|
| SMILES | CC1=CC=CC=C1OCC(CN2C3=C(N=C2SCC(CO)O)N(C(=O)NC3=O)C)O |
Product Overview
AB00131501-02 (CAS 392249-23-9), with molecular formula C19H24N4O6S and molecular weight 436.14 g/mol. IUPAC: 8-(2,3-dihydroxypropylsulfanyl)-7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methylpurine-2,6-dione.
Chemical Property Profile of AB00131501-02
Property Insights of AB00131501-02
The XLogP value of -0.38308 indicates that AB00131501-02 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 142.6 Ų indicates high polarity, suggesting AB00131501-02 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AB00131501-02 has 4 hydrogen bond donor(s) and 8 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 AB00131501-02?
The CAS number of AB00131501-02 is 392249-23-9.
What is the molecular formula of AB00131501-02?
The molecular formula of AB00131501-02 is C19H24N4O6S.
What is the molecular weight of AB00131501-02?
The molecular weight of AB00131501-02 is 436.14 g/mol.
Where can I buy AB00131501-02?
You can request a quote for AB00131501-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00131501-02?
Yes, KEHONG BIO provides custom synthesis services for AB00131501-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.