AF-399/40756921
TL;DR: AF-399/40756921 (CAS 379236-82-5) is a chemical compound with molecular formula C25H17FN2O3S2 and molecular weight 476.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-5-(5-methylfuran-2-yl)-3-phenylthieno[2,3-d]pyrimidin-4-one
Also Known As: AF-399/40756921, 2-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-5-(5-methylfuran-2-yl)-3-phenylthieno[2,3-d]pyrimidin-4-one, F1174-3056, 2-((2-(4-fluorophenyl)-2-oxoethyl)thio)-5-(5-methylfuran-2-yl)-3-phenylthieno[2,3-d]pyrimidin-4(3H)-one, 2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-5-(5-methylfuran-2-yl)-3-phenyl-3H,4H-thieno[2,3-d]pyrimidin-4-one
| Molecular Formula | C25H17FN2O3S2 |
|---|---|
| Molecular Weight | 476.07 g/mol |
| LogP | 6.12972 |
| Topological Polar Surface Area | 65.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 476.06647 |
| Heavy Atoms | 33 |
| Complexity | 1519.3545 |
Chemical Identifiers
| CAS Number | 379236-82-5 |
|---|---|
| SMILES | CC1=CC=C(O1)C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)C4=CC=C(C=C4)F)C5=CC=CC=C5 |
Product Overview
AF-399/40756921 (CAS 379236-82-5), with molecular formula C25H17FN2O3S2 and molecular weight 476.07 g/mol. IUPAC: 2-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-5-(5-methylfuran-2-yl)-3-phenylthieno[2,3-d]pyrimidin-4-one.
Chemical Property Profile of AF-399/40756921
Property Insights of AF-399/40756921
The XLogP value of 6.12972 indicates that AF-399/40756921 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-399/40756921. Following Lipinski's Rule of Five, AF-399/40756921 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-399/40756921?
The CAS number of AF-399/40756921 is 379236-82-5.
What is the molecular formula of AF-399/40756921?
The molecular formula of AF-399/40756921 is C25H17FN2O3S2.
What is the molecular weight of AF-399/40756921?
The molecular weight of AF-399/40756921 is 476.07 g/mol.
Where can I buy AF-399/40756921?
You can request a quote for AF-399/40756921 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/40756921?
Yes, KEHONG BIO provides custom synthesis services for AF-399/40756921 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.