AF-399/40850937
TL;DR: AF-399/40850937 (CAS 379239-23-3) is a chemical compound with molecular formula C25H18N2O3S2 and molecular weight 458.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(5-methylfuran-2-yl)-2-phenacylsulfanyl-3-phenylthieno[2,3-d]pyrimidin-4-one
Also Known As: AF-399/40850937, F1174-3079, 5-(5-methylfuran-2-yl)-2-((2-oxo-2-phenylethyl)thio)-3-phenylthieno[2,3-d]pyrimidin-4(3H)-one, 5-(5-methylfuran-2-yl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-phenyl-3H,4H-thieno[2,3-d]pyrimidin-4-one, 5-(5-methylfuran-2-yl)-2-phenacylsulfanyl-3-phenylthieno[2,3-d]pyrimidin-4-one
| Molecular Formula | C25H18N2O3S2 |
|---|---|
| Molecular Weight | 458.08 g/mol |
| LogP | 5.99062 |
| Topological Polar Surface Area | 65.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 458.0759 |
| Heavy Atoms | 32 |
| Complexity | 1467.906 |
Chemical Identifiers
| CAS Number | 379239-23-3 |
|---|---|
| SMILES | CC1=CC=C(O1)C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)C4=CC=CC=C4)C5=CC=CC=C5 |
Product Overview
AF-399/40850937 (CAS 379239-23-3), with molecular formula C25H18N2O3S2 and molecular weight 458.08 g/mol. IUPAC: 5-(5-methylfuran-2-yl)-2-phenacylsulfanyl-3-phenylthieno[2,3-d]pyrimidin-4-one.
Chemical Property Profile of AF-399/40850937
Property Insights of AF-399/40850937
The XLogP value of 5.99062 indicates that AF-399/40850937 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.1 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/40850937. Following Lipinski's Rule of Five, AF-399/40850937 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AF-399/40850937?
The CAS number of AF-399/40850937 is 379239-23-3.
What is the molecular formula of AF-399/40850937?
The molecular formula of AF-399/40850937 is C25H18N2O3S2.
What is the molecular weight of AF-399/40850937?
The molecular weight of AF-399/40850937 is 458.08 g/mol.
Where can I buy AF-399/40850937?
You can request a quote for AF-399/40850937 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/40850937?
Yes, KEHONG BIO provides custom synthesis services for AF-399/40850937 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.