VU0607877-1
TL;DR: VU0607877-1 (CAS 189149-75-5) is a chemical compound with molecular formula C16H15ClN4O3S and molecular weight 378.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-7-ethyl-3-methylpurine-2,6-dione
Also Known As: VU0607877-1, 2,5-Cyclohexadien-1-one,3-methyl-4,4-diphenyl, AB01309563-01, 8-((2-(4-chlorophenyl)-2-oxoethyl)thio)-7-ethyl-3-methyl-1H-purine-2,6(3H,7H)-dione, F3260-0617
| Molecular Formula | C16H15ClN4O3S |
|---|---|
| Molecular Weight | 378.06 g/mol |
| LogP | 2.0716 |
| Topological Polar Surface Area | 89.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 378.05533 |
| Heavy Atoms | 25 |
| Complexity | 1065.9038 |
Chemical Identifiers
| CAS Number | 189149-75-5 |
|---|---|
| SMILES | CCN1C2=C(N=C1SCC(=O)C3=CC=C(C=C3)Cl)N(C(=O)NC2=O)C |
Product Overview
VU0607877-1 (CAS 189149-75-5), with molecular formula C16H15ClN4O3S and molecular weight 378.06 g/mol. IUPAC: 8-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-7-ethyl-3-methylpurine-2,6-dione.
Chemical Property Profile of VU0607877-1
Property Insights of VU0607877-1
The XLogP value of 2.0716 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0607877-1. The TPSA of 89.75 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0607877-1. Following Lipinski's Rule of Five, VU0607877-1 has 1 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 VU0607877-1?
The CAS number of VU0607877-1 is 189149-75-5.
What is the molecular formula of VU0607877-1?
The molecular formula of VU0607877-1 is C16H15ClN4O3S.
What is the molecular weight of VU0607877-1?
The molecular weight of VU0607877-1 is 378.06 g/mol.
Where can I buy VU0607877-1?
You can request a quote for VU0607877-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0607877-1?
Yes, KEHONG BIO provides custom synthesis services for VU0607877-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.