BAS 04914749
TL;DR: BAS 04914749 (CAS 442865-12-5) is a chemical compound with molecular formula C12H16N4O5S and molecular weight 328.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[7-(2-ethoxyethyl)-3-methyl-2,6-dioxopurin-8-yl]sulfanylacetic acid
Also Known As: BAS 04914749, UPCMLD0ENAT5829950:001, 2-((7-(2-ethoxyethyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)acetic acid, AB00673616-01, AB00673616-02
| Molecular Formula | C12H16N4O5S |
|---|---|
| Molecular Weight | 328.08 g/mol |
| LogP | -0.3635 |
| Topological Polar Surface Area | 119.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 328.08414 |
| Heavy Atoms | 22 |
| Complexity | 806.1751 |
Chemical Identifiers
| CAS Number | 442865-12-5 |
|---|---|
| SMILES | CCOCCN1C2=C(N=C1SCC(=O)O)N(C(=O)NC2=O)C |
Product Overview
BAS 04914749 (CAS 442865-12-5), with molecular formula C12H16N4O5S and molecular weight 328.08 g/mol. IUPAC: 2-[7-(2-ethoxyethyl)-3-methyl-2,6-dioxopurin-8-yl]sulfanylacetic acid.
Chemical Property Profile of BAS 04914749
Property Insights of BAS 04914749
The XLogP value of -0.3635 indicates that BAS 04914749 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 119.21 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04914749. Following Lipinski's Rule of Five, BAS 04914749 has 2 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 04914749?
The CAS number of BAS 04914749 is 442865-12-5.
What is the molecular formula of BAS 04914749?
The molecular formula of BAS 04914749 is C12H16N4O5S.
What is the molecular weight of BAS 04914749?
The molecular weight of BAS 04914749 is 328.08 g/mol.
Where can I buy BAS 04914749?
You can request a quote for BAS 04914749 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04914749?
Yes, KEHONG BIO provides custom synthesis services for BAS 04914749 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.