BAS 00964907
TL;DR: BAS 00964907 (CAS 333768-97-1) is a chemical compound with molecular formula C11H14N4O5S and molecular weight 314.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[7-(2-methoxyethyl)-3-methyl-2,6-dioxopurin-8-yl]sulfanylacetic acid
Also Known As: BAS 00964907, UPCMLD0ENAT5832969:001, AB01133486-02, 2-((7-(2-methoxyethyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)acetic acid, F0372-0663
| Molecular Formula | C11H14N4O5S |
|---|---|
| Molecular Weight | 314.07 g/mol |
| LogP | -0.7536 |
| Topological Polar Surface Area | 119.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 314.06848 |
| Heavy Atoms | 21 |
| Complexity | 790.2331 |
Chemical Identifiers
| CAS Number | 333768-97-1 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N(C(=N2)SCC(=O)O)CCOC |
Product Overview
BAS 00964907 (CAS 333768-97-1), with molecular formula C11H14N4O5S and molecular weight 314.07 g/mol. IUPAC: 2-[7-(2-methoxyethyl)-3-methyl-2,6-dioxopurin-8-yl]sulfanylacetic acid.
Chemical Property Profile of BAS 00964907
Property Insights of BAS 00964907
The XLogP value of -0.7536 indicates that BAS 00964907 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 00964907. Following Lipinski's Rule of Five, BAS 00964907 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 00964907?
The CAS number of BAS 00964907 is 333768-97-1.
What is the molecular formula of BAS 00964907?
The molecular formula of BAS 00964907 is C11H14N4O5S.
What is the molecular weight of BAS 00964907?
The molecular weight of BAS 00964907 is 314.07 g/mol.
Where can I buy BAS 00964907?
You can request a quote for BAS 00964907 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00964907?
Yes, KEHONG BIO provides custom synthesis services for BAS 00964907 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.