AF-399/40654507
TL;DR: AF-399/40654507 (CAS 315709-64-9) is a chemical compound with molecular formula C21H25ClN2O4S and molecular weight 436.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-chlorophenyl)-2-[[2-(2,6-dimethylmorpholin-4-yl)acetyl]amino]thiophene-3-carboxylate
Also Known As: AF-399/40654507, F1174-1275, Ethyl 4-(4-chlorophenyl)-2-[[2-(2,6-dimethylmorpholin-4-yl)acetyl]amino]thiophene-3-carboxylate, ETHYL 4-(4-CHLOROPHENYL)-2-[2-(2,6-DIMETHYLMORPHOLIN-4-YL)ACETAMIDO]THIOPHENE-3-CARBOXYLATE, ethyl 4-(4-chlorophenyl)-2-(2-(2,6-dimethylmorpholino)acetamido)thiophene-3-carboxylate
| Molecular Formula | C21H25ClN2O4S |
|---|---|
| Molecular Weight | 436.12 g/mol |
| LogP | 4.2929 |
| Topological Polar Surface Area | 67.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 436.12234 |
| Heavy Atoms | 29 |
| Complexity | 858.0661 |
Chemical Identifiers
| CAS Number | 315709-64-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Cl)NC(=O)CN3CC(OC(C3)C)C |
Product Overview
AF-399/40654507 (CAS 315709-64-9), with molecular formula C21H25ClN2O4S and molecular weight 436.12 g/mol. IUPAC: ethyl 4-(4-chlorophenyl)-2-[[2-(2,6-dimethylmorpholin-4-yl)acetyl]amino]thiophene-3-carboxylate.
Chemical Property Profile of AF-399/40654507
Property Insights of AF-399/40654507
The XLogP value of 4.2929 indicates that AF-399/40654507 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.87 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/40654507. Following Lipinski's Rule of Five, AF-399/40654507 has 1 hydrogen bond donor(s) and 6 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-399/40654507?
The CAS number of AF-399/40654507 is 315709-64-9.
What is the molecular formula of AF-399/40654507?
The molecular formula of AF-399/40654507 is C21H25ClN2O4S.
What is the molecular weight of AF-399/40654507?
The molecular weight of AF-399/40654507 is 436.12 g/mol.
Where can I buy AF-399/40654507?
You can request a quote for AF-399/40654507 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/40654507?
Yes, KEHONG BIO provides custom synthesis services for AF-399/40654507 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.