AF-399/13428300
TL;DR: AF-399/13428300 (CAS 302803-48-1) is a chemical compound with molecular formula C18H20ClNO4S and molecular weight 381.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate
Also Known As: AF-399/13428300, ethyl 2-{[(4-chloro-3-methylphenoxy)acetyl]amino}-4,5-dimethyl-3-thiophenecarboxylate, ethyl 2-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate, ethyl 2-(2-(4-chloro-3-methylphenoxy)acetamido)-4,5-dimethylthiophene-3-carboxylate, ETHYL 2-[2-(4-CHLORO-3-METHYLPHENOXY)ACETAMIDO]-4,5-DIMETHYLTHIOPHENE-3-CARBOXYLATE
| Molecular Formula | C18H20ClNO4S |
|---|---|
| Molecular Weight | 381.08 g/mol |
| LogP | 4.52096 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 381.08017 |
| Heavy Atoms | 25 |
| Complexity | 800.614 |
Chemical Identifiers
| CAS Number | 302803-48-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C)NC(=O)COC2=CC(=C(C=C2)Cl)C |
Product Overview
AF-399/13428300 (CAS 302803-48-1), with molecular formula C18H20ClNO4S and molecular weight 381.08 g/mol. IUPAC: ethyl 2-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate.
Chemical Property Profile of AF-399/13428300
Property Insights of AF-399/13428300
The XLogP value of 4.52096 indicates that AF-399/13428300 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/13428300. Following Lipinski's Rule of Five, AF-399/13428300 has 1 hydrogen bond donor(s) and 5 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-399/13428300?
The CAS number of AF-399/13428300 is 302803-48-1.
What is the molecular formula of AF-399/13428300?
The molecular formula of AF-399/13428300 is C18H20ClNO4S.
What is the molecular weight of AF-399/13428300?
The molecular weight of AF-399/13428300 is 381.08 g/mol.
Where can I buy AF-399/13428300?
You can request a quote for AF-399/13428300 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/13428300?
Yes, KEHONG BIO provides custom synthesis services for AF-399/13428300 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.