AF-399/40703915
TL;DR: AF-399/40703915 (CAS 379244-58-3) is a chemical compound with molecular formula C19H10ClF2N3OS and molecular weight 401.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-chlorophenyl)-3-[(E)-(2,6-difluorophenyl)methylideneamino]thieno[2,3-d]pyrimidin-4-one
Also Known As: AF-399/40703915, 5-(4-chlorophenyl)-3-[(E)-(2,6-difluorophenyl)methylideneamino]thieno[2,3-d]pyrimidin-4-one, 5-(4-chlorophenyl)-3-[(2,6-difluorobenzylidene)amino]thieno[2,3-d]pyrimidin-4(3H)-one, 3-[(1E)-2-(2,6-difluorophenyl)-1-azavinyl]-5-(4-chlorophenyl)-3-hydrothiopheno [2,3-d]pyrimidin-4-one, 5-(4-chlorophenyl)-3-{[(E)-(2,6-difluorophenyl)methylidene]amino}thieno[2,3-d]pyrimidin-4(3H)-one
| Molecular Formula | C19H10ClF2N3OS |
|---|---|
| Molecular Weight | 401.02 g/mol |
| LogP | 4.9388 |
| Topological Polar Surface Area | 47.25 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 401.0201 |
| Heavy Atoms | 27 |
| Complexity | 1211.9176 |
Chemical Identifiers
| CAS Number | 379244-58-3 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)F)/C=N/N2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)Cl)F |
Product Overview
AF-399/40703915 (CAS 379244-58-3), with molecular formula C19H10ClF2N3OS and molecular weight 401.02 g/mol. IUPAC: 5-(4-chlorophenyl)-3-[(E)-(2,6-difluorophenyl)methylideneamino]thieno[2,3-d]pyrimidin-4-one.
Chemical Property Profile of AF-399/40703915
Property Insights of AF-399/40703915
The XLogP value of 4.9388 indicates that AF-399/40703915 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.25 Ų, AF-399/40703915 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AF-399/40703915 has 0 hydrogen bond donor(s) and 4 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-399/40703915?
The CAS number of AF-399/40703915 is 379244-58-3.
What is the molecular formula of AF-399/40703915?
The molecular formula of AF-399/40703915 is C19H10ClF2N3OS.
What is the molecular weight of AF-399/40703915?
The molecular weight of AF-399/40703915 is 401.02 g/mol.
Where can I buy AF-399/40703915?
You can request a quote for AF-399/40703915 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/40703915?
Yes, KEHONG BIO provides custom synthesis services for AF-399/40703915 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.