AF-399/40851687
TL;DR: AF-399/40851687 (CAS 379236-70-1) is a chemical compound with molecular formula C25H19N3O3S3 and molecular weight 505.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-methoxyphenyl)-2-(4-oxo-3-phenyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide
Also Known As: AF-399/40851687, F1174-3043, N-(3-methoxyphenyl)-2-(4-oxo-3-phenyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide, N-(3-methoxyphenyl)-2-((4-oxo-3-phenyl-5-(thiophen-2-yl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)thio)acetamide, N-(3-methoxyphenyl)-2-{[4-oxo-3-phenyl-5-(thiophen-2-yl)-3H,4H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
| Molecular Formula | C25H19N3O3S3 |
|---|---|
| Molecular Weight | 505.06 g/mol |
| LogP | 5.9151 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 505.05887 |
| Heavy Atoms | 34 |
| Complexity | 1509.2538 |
Chemical Identifiers
| CAS Number | 379236-70-1 |
|---|---|
| SMILES | COC1=CC=CC(=C1)NC(=O)CSC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2C5=CC=CC=C5 |
Product Overview
AF-399/40851687 (CAS 379236-70-1), with molecular formula C25H19N3O3S3 and molecular weight 505.06 g/mol. IUPAC: N-(3-methoxyphenyl)-2-(4-oxo-3-phenyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide.
Chemical Property Profile of AF-399/40851687
Property Insights of AF-399/40851687
The XLogP value of 5.9151 indicates that AF-399/40851687 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.22 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/40851687. Following Lipinski's Rule of Five, AF-399/40851687 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AF-399/40851687?
The CAS number of AF-399/40851687 is 379236-70-1.
What is the molecular formula of AF-399/40851687?
The molecular formula of AF-399/40851687 is C25H19N3O3S3.
What is the molecular weight of AF-399/40851687?
The molecular weight of AF-399/40851687 is 505.06 g/mol.
Where can I buy AF-399/40851687?
You can request a quote for AF-399/40851687 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/40851687?
Yes, KEHONG BIO provides custom synthesis services for AF-399/40851687 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.