AF-399/40851728
TL;DR: AF-399/40851728 (CAS 379236-52-9) is a chemical compound with molecular formula C22H19N3O3S3 and molecular weight 469.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-phenyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-one
Also Known As: AF-399/40851728, 2-((2-morpholino-2-oxoethyl)thio)-3-phenyl-5-(thiophen-2-yl)thieno[2,3-d]pyrimidin-4(3H)-one, F1174-3026, 2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-phenyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-one, 2-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-3-phenyl-5-(thiophen-2-yl)-3H,4H-thieno[2,3-d]pyrimidin-4-one
| Molecular Formula | C22H19N3O3S3 |
|---|---|
| Molecular Weight | 469.06 g/mol |
| LogP | 4.1266 |
| Topological Polar Surface Area | 64.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 469.05887 |
| Heavy Atoms | 31 |
| Complexity | 1259.891 |
Chemical Identifiers
| CAS Number | 379236-52-9 |
|---|---|
| SMILES | C1COCCN1C(=O)CSC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2C5=CC=CC=C5 |
Product Overview
AF-399/40851728 (CAS 379236-52-9), with molecular formula C22H19N3O3S3 and molecular weight 469.06 g/mol. IUPAC: 2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-phenyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-one.
Chemical Property Profile of AF-399/40851728
Property Insights of AF-399/40851728
The XLogP value of 4.1266 indicates that AF-399/40851728 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.43 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/40851728. Following Lipinski's Rule of Five, AF-399/40851728 has 0 hydrogen bond donor(s) and 7 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 AF-399/40851728?
The CAS number of AF-399/40851728 is 379236-52-9.
What is the molecular formula of AF-399/40851728?
The molecular formula of AF-399/40851728 is C22H19N3O3S3.
What is the molecular weight of AF-399/40851728?
The molecular weight of AF-399/40851728 is 469.06 g/mol.
Where can I buy AF-399/40851728?
You can request a quote for AF-399/40851728 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/40851728?
Yes, KEHONG BIO provides custom synthesis services for AF-399/40851728 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.