VU0607879-1
TL;DR: VU0607879-1 (CAS 189149-98-2) is a chemical compound with molecular formula C11H14N4O4S and molecular weight 298.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(7-ethyl-3-methyl-2,6-dioxopurin-8-yl)sulfanylpropanoic acid
Also Known As: VU0607879-1, 3-((7-ethyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)propanoic acid, 3-(7-ethyl-3-methyl-2,6-dioxopurin-8-yl)sulfanylpropanoic acid, F3260-0623, 3-[(7-ethyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]propanoic acid
| Molecular Formula | C11H14N4O4S |
|---|---|
| Molecular Weight | 298.07 g/mol |
| LogP | 0.01 |
| Topological Polar Surface Area | 109.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 298.07358 |
| Heavy Atoms | 20 |
| Complexity | 773.0467 |
Chemical Identifiers
| CAS Number | 189149-98-2 |
|---|---|
| SMILES | CCN1C2=C(N=C1SCCC(=O)O)N(C(=O)NC2=O)C |
Product Overview
VU0607879-1 (CAS 189149-98-2), with molecular formula C11H14N4O4S and molecular weight 298.07 g/mol. IUPAC: 3-(7-ethyl-3-methyl-2,6-dioxopurin-8-yl)sulfanylpropanoic acid.
Chemical Property Profile of VU0607879-1
Property Insights of VU0607879-1
The XLogP value of 0.01 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0607879-1. The TPSA of 109.98 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0607879-1. Following Lipinski's Rule of Five, VU0607879-1 has 2 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 VU0607879-1?
The CAS number of VU0607879-1 is 189149-98-2.
What is the molecular formula of VU0607879-1?
The molecular formula of VU0607879-1 is C11H14N4O4S.
What is the molecular weight of VU0607879-1?
The molecular weight of VU0607879-1 is 298.07 g/mol.
Where can I buy VU0607879-1?
You can request a quote for VU0607879-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0607879-1?
Yes, KEHONG BIO provides custom synthesis services for VU0607879-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.